(2S,4R)-N-[(1R)-1-(cyclopropylsulfonylcarbamoyl)-2-ethenyl-cyclopropyl]-1-[(2S)-3,3-dimethyl-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)butanoyl]-4-(4,5-diphenyl-1,2,3-triazol-2-yl)pyrrolidine-2-carboxamide

Systemtic Name: (2S,4R)-N-[(1R)-1-(cyclopropylsulfonylcarbamoyl)-2-ethenyl-cyclopropyl]-1-[(2S)-3,3-dimethyl-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)butanoyl]-4-(4,5-diphenyl-1,2,3-triazol-2-yl)pyrrolidine-2-carboxamide Openeye Name: (2S,4R)-N-[(1R)-1-(cyclopropylsulfonylcarbamoyl)-2-vinyl-cyclopropyl]-1-[(2S)-3,3-dimethyl-2-[2-oxo-2-(1-piperidyl)ethyl]butanoyl]-4-(4,5-diphenyltriazol-2-yl)pyrrolidine-2-carboxamide CAS Name: (2S,4R)-N-[(1R)-1-[(cyclopropylsulfonylamino)-oxomethyl]-2-ethenylcyclopropyl]-1-[(2S)-3,3-dimethyl-1-oxo-2-[2-oxo-2-(1-piperidinyl)ethyl]butyl]-4-(4,5-diphenyl-2-triazolyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S,4R)-N-[(1R)-1-(cyclopropylsulfonylcarbamoyl)-2-ethenylcyclopropyl]-1-[(2S)-3,3-dimethyl-2-(2-oxo-2-piperidin-1-ylethyl)butanoyl]-4-(4,5-diphenyltriazol-2-yl)pyrrolidine-2-carboxamide Traditional Name: (2S,4R)-N-[(1R)-1-(cyclopropylsulfonylcarbamoyl)-2-vinyl-cyclopropyl]-4-(4,5-diphenyltriazol-2-yl)-1-[(2S)-2-(2-keto-2-piperidino-ethyl)-3,3-dimethyl-butanoyl]pyrrolidine-2-carboxamide Formula: C41H51N7O6S MolecularWeight: 769.95194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CC(=O)N1CCCCC1)C(=O)N2CC(CC2C(=O)NC3(CC3C=C)C(=O)NS(=O)(=O)C4CC4)N5N=C(C(=N5)C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

CC(C)(C)[C@H](CC(=O)N1CCCCC1)C(=O)N2C[C@@H](C[C@H]2C(=O)N[C@@]3(CC3C=C)C(=O)NS(=O)(=O)C4CC4)N5N=C(C(=N5)C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C41H51N7O6S/c1-5-29-25-41(29,39(52)45-55(53,54)31-19-20-31)42-37(50)33-23-30(26-47(33)38(51)32(40(2,3)4)24-34(49)46-21-13-8-14-22-46)48-43-35(27-15-9-6-10-16-27)36(44-48)28-17-11-7-12-18-28/h5-7,9-12,15-18,29-33H,1,8,13-14,19-26H2,2-4H3,(H,42,50)(H,45,52)/t29?,30-,32-,33+,41-/m1/s1