(2R)-2-(4-nitrophenyl)sulfanyl-N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]propanamide

Systemtic Name: (2R)-2-(4-nitrophenyl)sulfanyl-N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]propanamide Openeye Name: (2R)-2-(4-nitrophenyl)sulfanyl-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]propanamide CAS Name: (2R)-2-[(4-nitrophenyl)thio]-N-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]propanamide IUPAC Name: (2R)-2-(4-nitrophenyl)sulfanyl-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]propanamide Traditional Name: (2R)-N-[4-(2-ketopyrrolidino)benzyl]-2-[(4-nitrophenyl)thio]propionamide Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)N2CCCC2=O)SC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C(=O)NCC1=CC=C(C=C1)N2CCCC2=O)SC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O4S/c1-14(28-18-10-8-17(9-11-18)23(26)27)20(25)21-13-15-4-6-16(7-5-15)22-12-2-3-19(22)24/h4-11,14H,2-3,12-13H2,1H3,(H,21,25)/t14-/m1/s1