3-(butylamino)-N-[(3R)-4-[[(2S)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]amino]-3-oxidanyl-1-phenyl-butan-2-yl]-5-(2-oxidanylidenepyrrolidin-1-yl)benzamide

Systemtic Name: 3-(butylamino)-N-[(3R)-4-[[(2S)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]amino]-3-oxidanyl-1-phenyl-butan-2-yl]-5-(2-oxidanylidenepyrrolidin-1-yl)benzamide Openeye Name: N-[(2R)-1-benzyl-3-[[(1S)-2-(cyclohexylamino)-1-methyl-2-oxo-ethyl]amino]-2-hydroxy-propyl]-3-(butylamino)-5-(2-oxopyrrolidin-1-yl)benzamide CAS Name: 3-(butylamino)-N-[(3R)-4-[[(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl]amino]-3-hydroxy-1-phenylbutan-2-yl]-5-(2-oxo-1-pyrrolidinyl)benzamide IUPAC Name: 3-(butylamino)-N-[(3R)-4-[[(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl]amino]-3-hydroxy-1-phenylbutan-2-yl]-5-(2-oxopyrrolidin-1-yl)benzamide Traditional Name: N-[(2R)-1-benzyl-3-[[(1S)-2-(cyclohexylamino)-2-keto-1-methyl-ethyl]amino]-2-hydroxy-propyl]-3-(butylamino)-5-(2-ketopyrrolidino)benzamide Formula: C34H49N5O4 MolecularWeight: 591.78396

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=CC(=CC(=C1)N2CCCC2=O)C(=O)NC(CC3=CC=CC=C3)C(CNC(C)C(=O)NC4CCCCC4)O

Isomeric SMILES

CCCCNC1=CC(=CC(=C1)N2CCCC2=O)C(=O)NC(CC3=CC=CC=C3)[C@@H](CN[C@@H](C)C(=O)NC4CCCCC4)O

InChI

InChI=1S/C34H49N5O4/c1-3-4-17-35-28-20-26(21-29(22-28)39-18-11-16-32(39)41)34(43)38-30(19-25-12-7-5-8-13-25)31(40)23-36-24(2)33(42)37-27-14-9-6-10-15-27/h5,7-8,12-13,20-22,24,27,30-31,35-36,40H,3-4,6,9-11,14-19,23H2,1-2H3,(H,37,42)(H,38,43)/t24-,30?,31+/m0/s1