(3S)-5-oxidanylidene-1-phenethyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)pyrrolidine-3-carboxamide

Systemtic Name: (3S)-5-oxidanylidene-1-phenethyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)pyrrolidine-3-carboxamide Openeye Name: (3S)-5-oxo-1-phenethyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)pyrrolidine-3-carboxamide CAS Name: (3S)-5-oxo-1-phenethyl-N-[4-(1-pyrrolidinylsulfonyl)phenyl]-3-pyrrolidinecarboxamide IUPAC Name: (3S)-5-oxo-1-phenethyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)pyrrolidine-3-carboxamide Traditional Name: (3S)-5-keto-1-phenethyl-N-(4-pyrrolidinosulfonylphenyl)pyrrolidine-3-carboxamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CC(=O)N(C3)CCC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)[C@H]3CC(=O)N(C3)CCC4=CC=CC=C4

InChI

InChI=1S/C23H27N3O4S/c27-22-16-19(17-25(22)15-12-18-6-2-1-3-7-18)23(28)24-20-8-10-21(11-9-20)31(29,30)26-13-4-5-14-26/h1-3,6-11,19H,4-5,12-17H2,(H,24,28)/t19-/m0/s1