(Z)-3-[(2-methylphenyl)amino]-3-methylsulfanyl-2-(4-nitrophenyl)prop-2-enamide

Systemtic Name: (Z)-3-[(2-methylphenyl)amino]-3-methylsulfanyl-2-(4-nitrophenyl)prop-2-enamide Openeye Name: (Z)-3-(2-methylanilino)-3-methylsulfanyl-2-(4-nitrophenyl)prop-2-enamide CAS Name: (Z)-3-(2-methylanilino)-3-(methylthio)-2-(4-nitrophenyl)-2-propenamide IUPAC Name: (Z)-3-(2-methylanilino)-3-methylsulfanyl-2-(4-nitrophenyl)prop-2-enamide Traditional Name: (Z)-3-(methylthio)-2-(4-nitrophenyl)-3-(o-toluidino)acrylamide Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=C(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)N)SC

Isomeric SMILES

CC1=CC=CC=C1N/C(=C(\C2=CC=C(C=C2)[N+](=O)[O-])/C(=O)N)/SC

InChI

InChI=1S/C17H17N3O3S/c1-11-5-3-4-6-14(11)19-17(24-2)15(16(18)21)12-7-9-13(10-8-12)20(22)23/h3-10,19H,1-2H3,(H2,18,21)/b17-15-