N3-[(3S,5S)-1-[(2S,3R)-2-[[(2S)-2-(methylamino)propanoyl]amino]-3-oxidanyl-butanoyl]-5-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl]pyrrolidin-3-yl]-N5-[(3S,5S)-1-[(2S,3R)-2-[[(2S)-2-(methylamino)propanoyl]amino]-3-oxidanyl-butanoyl]-5-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamoyl)pyrrolidin-3-yl]-1H-pyrazole-3,5-dicarboxamide

Systemtic Name: N3-[(3S,5S)-1-[(2S,3R)-2-[[(2S)-2-(methylamino)propanoyl]amino]-3-oxidanyl-butanoyl]-5-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl]pyrrolidin-3-yl]-N5-[(3S,5S)-1-[(2S,3R)-2-[[(2S)-2-(methylamino)propanoyl]amino]-3-oxidanyl-butanoyl]-5-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamoyl)pyrrolidin-3-yl]-1H-pyrazole-3,5-dicarboxamide Openeye Name: N3-[(3S,5S)-1-[(2S,3R)-3-hydroxy-2-[[(2S)-2-(methylamino)propanoyl]amino]butanoyl]-5-[[(1R)-tetralin-1-yl]carbamoyl]pyrrolidin-3-yl]-N5-[(3S,5S)-1-[(2S,3R)-3-hydroxy-2-[[(2S)-2-(methylamino)propanoyl]amino]butanoyl]-5-(tetralin-1-ylcarbamoyl)pyrrolidin-3-yl]-1H-pyrazole-3,5-dicarboxamide CAS Name: N3-[(3S,5S)-1-[(2S,3R)-3-hydroxy-2-[[(2S)-2-(methylamino)-1-oxopropyl]amino]-1-oxobutyl]-5-[oxo-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]methyl]-3-pyrrolidinyl]-N5-[(3S,5S)-1-[(2S,3R)-3-hydroxy-2-[[(2S)-2-(methylamino)-1-oxopropyl]amino]-1-oxobutyl]-5-[oxo-(1,2,3,4-tetrahydronaphthalen-1-ylamino)methyl]-3-pyrrolidinyl]-1H-pyrazole-3,5-dicarboxamide IUPAC Name: 3-N-[(3S,5S)-1-[(2S,3R)-3-hydroxy-2-[[(2S)-2-(methylamino)propanoyl]amino]butanoyl]-5-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl]pyrrolidin-3-yl]-5-N-[(3S,5S)-1-[(2S,3R)-3-hydroxy-2-[[(2S)-2-(methylamino)propanoyl]amino]butanoyl]-5-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamoyl)pyrrolidin-3-yl]-1H-pyrazole-3,5-dicarboxamide Traditional Name: N-[(3S,5S)-1-[(2S,3R)-3-hydroxy-2-[[(2S)-2-(methylamino)propanoyl]amino]butanoyl]-5-[[(1R)-tetralin-1-yl]carbamoyl]pyrrolidin-3-yl]-N'-[(3S,5S)-1-[(2S,3R)-3-hydroxy-2-[[(2S)-2-(methylamino)propanoyl]amino]butanoyl]-5-(tetralin-1-ylcarbamoyl)pyrrolidin-3-yl]-1H-pyrazole-3,5-dicarboxamide Formula: C51H70N12O10 MolecularWeight: 1011.1759

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)N1CC(CC1C(=O)NC2CCCC3=CC=CC=C23)NC(=O)C4=CC(=NN4)C(=O)NC5CC(N(C5)C(=O)C(C(C)O)NC(=O)C(C)NC)C(=O)NC6CCCC7=CC=CC=C67)NC(=O)C(C)NC)O

Isomeric SMILES

C[C@H]([C@@H](C(=O)N1C[C@H](C[C@H]1C(=O)NC2CCCC3=CC=CC=C23)NC(=O)C4=CC(=NN4)C(=O)N[C@H]5C[C@H](N(C5)C(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](C)NC)C(=O)N[C@@H]6CCCC7=CC=CC=C67)NC(=O)[C@H](C)NC)O

InChI

InChI=1S/C51H70N12O10/c1-26(52-5)44(66)58-42(28(3)64)50(72)62-24-32(21-40(62)48(70)56-36-19-11-15-30-13-7-9-17-34(30)36)54-46(68)38-23-39(61-60-38)47(69)55-33-22-41(49(71)57-37-20-12-16-31-14-8-10-18-35(31)37)63(25-33)51(73)43(29(4)65)59-45(67)27(2)53-6/h7-10,13-14,17-18,23,26-29,32-33,36-37,40-43,52-53,64-65H,11-12,15-16,19-22,24-25H2,1-6H3,(H,54,68)(H,55,69)(H,56,70)(H,57,71)(H,58,66)(H,59,67)(H,60,61)/t26-,27-,28+,29+,32-,33-,36+,37?,40-,41-,42-,43-/m0/s1