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

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

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=C(C1=CC=C(C=C1)[N+](=O)[O-])C(=O)N)NCC2=CC=CC=C2

Isomeric SMILES

CS/C(=C(/C1=CC=C(C=C1)[N+](=O)[O-])\C(=O)N)/NCC2=CC=CC=C2

InChI

InChI=1S/C17H17N3O3S/c1-24-17(19-11-12-5-3-2-4-6-12)15(16(18)21)13-7-9-14(10-8-13)20(22)23/h2-10,19H,11H2,1H3,(H2,18,21)/b17-15-