(2S)-1-(4-methylphenyl)sulfonyl-N-[(1S)-1-[(3S)-5-oxidanylidene-1-(phenylmethyl)pyrrolidin-3-yl]ethyl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-(4-methylphenyl)sulfonyl-N-[(1S)-1-[(3S)-5-oxidanylidene-1-(phenylmethyl)pyrrolidin-3-yl]ethyl]pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[(1S)-1-[(3S)-1-benzyl-5-oxo-pyrrolidin-3-yl]ethyl]-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-1-(4-methylphenyl)sulfonyl-N-[(1S)-1-[(3S)-5-oxo-1-(phenylmethyl)-3-pyrrolidinyl]ethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[(1S)-1-[(3S)-1-benzyl-5-oxopyrrolidin-3-yl]ethyl]-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: (2S)-N-[(1S)-1-[(3S)-1-benzyl-5-keto-pyrrolidin-3-yl]ethyl]-1-tosyl-pyrrolidine-2-carboxamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC(C)C3CC(=O)N(C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)N[C@@H](C)[C@H]3CC(=O)N(C3)CC4=CC=CC=C4

InChI

InChI=1S/C25H31N3O4S/c1-18-10-12-22(13-11-18)33(31,32)28-14-6-9-23(28)25(30)26-19(2)21-15-24(29)27(17-21)16-20-7-4-3-5-8-20/h3-5,7-8,10-13,19,21,23H,6,9,14-17H2,1-2H3,(H,26,30)/t19-,21-,23-/m0/s1