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

Systemtic Name: 2-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(4-methyl-3-nitro-phenyl)benzamide Openeye Name: 2-[2-(3-methoxyanilino)-2-oxo-ethyl]sulfanyl-N-(4-methyl-3-nitro-phenyl)benzamide CAS Name: 2-[[2-(3-methoxyanilino)-2-oxoethyl]thio]-N-(4-methyl-3-nitrophenyl)benzamide IUPAC Name: 2-[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl-N-(4-methyl-3-nitrophenyl)benzamide Traditional Name: 2-[[2-keto-2-(m-anisidino)ethyl]thio]-N-(4-methyl-3-nitro-phenyl)benzamide Formula: C23H21N3O5S MolecularWeight: 451.49494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2SCC(=O)NC3=CC(=CC=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2SCC(=O)NC3=CC(=CC=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O5S/c1-15-10-11-17(13-20(15)26(29)30)25-23(28)19-8-3-4-9-21(19)32-14-22(27)24-16-6-5-7-18(12-16)31-2/h3-13H,14H2,1-2H3,(H,24,27)(H,25,28)