4-[[(E)-2-cyano-3-(4-methylsulfanylphenyl)prop-2-enoyl]amino]-N,N-dimethyl-benzamide

Systemtic Name: 4-[[(E)-2-cyano-3-(4-methylsulfanylphenyl)prop-2-enoyl]amino]-N,N-dimethyl-benzamide Openeye Name: 4-[[(E)-2-cyano-3-(4-methylsulfanylphenyl)prop-2-enoyl]amino]-N,N-dimethyl-benzamide CAS Name: 4-[[(E)-2-cyano-3-[4-(methylthio)phenyl]-1-oxoprop-2-enyl]amino]-N,N-dimethylbenzamide IUPAC Name: 4-[[(E)-2-cyano-3-(4-methylsulfanylphenyl)prop-2-enoyl]amino]-N,N-dimethylbenzamide Traditional Name: 4-[[(E)-2-cyano-3-[4-(methylthio)phenyl]acryloyl]amino]-N,N-dimethyl-benzamide Formula: C20H19N3O2S MolecularWeight: 365.44876

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC=C(C=C1)NC(=O)C(=CC2=CC=C(C=C2)SC)C#N

Isomeric SMILES

CN(C)C(=O)C1=CC=C(C=C1)NC(=O)/C(=C/C2=CC=C(C=C2)SC)/C#N

InChI

InChI=1S/C20H19N3O2S/c1-23(2)20(25)15-6-8-17(9-7-15)22-19(24)16(13-21)12-14-4-10-18(26-3)11-5-14/h4-12H,1-3H3,(H,22,24)/b16-12+