2-[2-[(4-methyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-phenyl-ethanamide

Systemtic Name: 2-[2-[(4-methyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-phenyl-ethanamide Openeye Name: 2-[2-(4-methyl-3-nitro-anilino)-2-oxo-ethyl]sulfanyl-N-phenyl-acetamide CAS Name: 2-[[2-(4-methyl-3-nitroanilino)-2-oxoethyl]thio]-N-phenylacetamide IUPAC Name: 2-[2-(4-methyl-3-nitroanilino)-2-oxoethyl]sulfanyl-N-phenylacetamide Traditional Name: 2-[[2-keto-2-(4-methyl-3-nitro-anilino)ethyl]thio]-N-phenyl-acetamide Formula: C17H17N3O4S MolecularWeight: 359.39958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSCC(=O)NC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSCC(=O)NC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O4S/c1-12-7-8-14(9-15(12)20(23)24)19-17(22)11-25-10-16(21)18-13-5-3-2-4-6-13/h2-9H,10-11H2,1H3,(H,18,21)(H,19,22)