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

Systemtic Name: 4-ethoxy-N-methyl-N-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: 4-ethoxy-N-methyl-N-[2-(2-methylsulfanylanilino)-2-oxo-ethyl]-3-nitro-benzamide CAS Name: 4-ethoxy-N-methyl-N-[2-[2-(methylthio)anilino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: 4-ethoxy-N-methyl-N-[2-(2-methylsulfanylanilino)-2-oxoethyl]-3-nitrobenzamide Traditional Name: 4-ethoxy-N-[2-keto-2-[2-(methylthio)anilino]ethyl]-N-methyl-3-nitro-benzamide Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)N(C)CC(=O)NC2=CC=CC=C2SC)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N(C)CC(=O)NC2=CC=CC=C2SC)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O5S/c1-4-27-16-10-9-13(11-15(16)22(25)26)19(24)21(2)12-18(23)20-14-7-5-6-8-17(14)28-3/h5-11H,4,12H2,1-3H3,(H,20,23)