tert-butyl (2S)-1-[(2S,3S)-2-[[(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylsulfanyl-butanoyl]amino]propanoyl]amino]-3-methyl-pentanoyl]pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl (2S)-1-[(2S,3S)-2-[[(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylsulfanyl-butanoyl]amino]propanoyl]amino]-3-methyl-pentanoyl]pyrrolidine-2-carboxylate Openeye Name: tert-butyl (2S)-1-[(2S,3S)-2-[[(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylsulfanyl-butanoyl]amino]propanoyl]amino]-3-methyl-pentanoyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-(methylthio)-1-oxobutyl]amino]-1-oxopropyl]amino]-3-methyl-1-oxopentyl]-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-1-[(2S,3S)-2-[[(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylsulfanylbutanoyl]amino]propanoyl]amino]-3-methylpentanoyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[(2S,3S)-2-[[(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-(methylthio)butanoyl]amino]propanoyl]amino]-3-methyl-pentanoyl]pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C38H52N4O7S MolecularWeight: 708.90708

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCCC1C(=O)OC(C)(C)C)NC(=O)C(C)NC(=O)C(CCSC)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)N1CCC[C@H]1C(=O)OC(C)(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

InChI

InChI=1S/C38H52N4O7S/c1-8-23(2)32(35(45)42-20-13-18-31(42)36(46)49-38(4,5)6)41-33(43)24(3)39-34(44)30(19-21-50-7)40-37(47)48-22-29-27-16-11-9-14-25(27)26-15-10-12-17-28(26)29/h9-12,14-17,23-24,29-32H,8,13,18-22H2,1-7H3,(H,39,44)(H,40,47)(H,41,43)/t23-,24-,30-,31-,32-/m0/s1