4-methyl-N-[2-[(4-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: 4-methyl-N-[2-[(4-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: 4-methyl-N-[2-(4-methylsulfanylanilino)-2-oxo-ethyl]-3-nitro-benzamide CAS Name: 4-methyl-N-[2-[4-(methylthio)anilino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: 4-methyl-N-[2-(4-methylsulfanylanilino)-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-[2-keto-2-[4-(methylthio)anilino]ethyl]-4-methyl-3-nitro-benzamide Formula: C17H17N3O4S MolecularWeight: 359.39958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(=O)NC2=CC=C(C=C2)SC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC(=O)NC2=CC=C(C=C2)SC)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O4S/c1-11-3-4-12(9-15(11)20(23)24)17(22)18-10-16(21)19-13-5-7-14(25-2)8-6-13/h3-9H,10H2,1-2H3,(H,18,22)(H,19,21)