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

Systemtic Name: N-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-4-methylsulfanyl-3-nitro-benzamide Openeye Name: N-[2-(3-methoxyanilino)-2-oxo-ethyl]-N-methyl-4-methylsulfanyl-3-nitro-benzamide CAS Name: N-[2-(3-methoxyanilino)-2-oxoethyl]-N-methyl-4-(methylthio)-3-nitrobenzamide IUPAC Name: N-[2-(3-methoxyanilino)-2-oxoethyl]-N-methyl-4-methylsulfanyl-3-nitrobenzamide Traditional Name: N-[2-keto-2-(m-anisidino)ethyl]-N-methyl-4-(methylthio)-3-nitro-benzamide Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC(=CC=C1)OC)C(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

Isomeric SMILES

CN(CC(=O)NC1=CC(=CC=C1)OC)C(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O5S/c1-20(11-17(22)19-13-5-4-6-14(10-13)26-2)18(23)12-7-8-16(27-3)15(9-12)21(24)25/h4-10H,11H2,1-3H3,(H,19,22)