N-[1-[(4-nitrophenyl)amino]-1-oxidanylidene-3-(phenylmethylsulfanyl)propan-2-yl]-2-pyrrolidin-2-yl-1,3-oxazole-4-carboxamide

Systemtic Name: N-[1-[(4-nitrophenyl)amino]-1-oxidanylidene-3-(phenylmethylsulfanyl)propan-2-yl]-2-pyrrolidin-2-yl-1,3-oxazole-4-carboxamide Openeye Name: N-[1-(benzylsulfanylmethyl)-2-(4-nitroanilino)-2-oxo-ethyl]-2-pyrrolidin-2-yl-oxazole-4-carboxamide CAS Name: N-[1-(4-nitroanilino)-1-oxo-3-(phenylmethylthio)propan-2-yl]-2-(2-pyrrolidinyl)-4-oxazolecarboxamide IUPAC Name: N-[3-benzylsulfanyl-1-(4-nitroanilino)-1-oxopropan-2-yl]-2-pyrrolidin-2-yl-1,3-oxazole-4-carboxamide Traditional Name: N-[1-[(benzylthio)methyl]-2-keto-2-(4-nitroanilino)ethyl]-2-pyrrolidin-2-yl-oxazole-4-carboxamide Formula: C24H25N5O5S MolecularWeight: 495.5508

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C2=NC(=CO2)C(=O)NC(CSCC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC(NC1)C2=NC(=CO2)C(=O)NC(CSCC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H25N5O5S/c30-22(20-13-34-24(28-20)19-7-4-12-25-19)27-21(15-35-14-16-5-2-1-3-6-16)23(31)26-17-8-10-18(11-9-17)29(32)33/h1-3,5-6,8-11,13,19,21,25H,4,7,12,14-15H2,(H,26,31)(H,27,30)