(Z)-2-(3,4-dimethoxyphenyl)-3-(2-methylsulfanylquinolin-3-yl)prop-2-enenitrile

Systemtic Name: (Z)-2-(3,4-dimethoxyphenyl)-3-(2-methylsulfanylquinolin-3-yl)prop-2-enenitrile Openeye Name: (Z)-2-(3,4-dimethoxyphenyl)-3-(2-methylsulfanyl-3-quinolyl)prop-2-enenitrile CAS Name: (Z)-2-(3,4-dimethoxyphenyl)-3-[2-(methylthio)-3-quinolinyl]-2-propenenitrile IUPAC Name: (Z)-2-(3,4-dimethoxyphenyl)-3-(2-methylsulfanylquinolin-3-yl)prop-2-enenitrile Traditional Name: (Z)-2-(3,4-dimethoxyphenyl)-3-[2-(methylthio)-3-quinolyl]acrylonitrile Formula: C21H18N2O2S MolecularWeight: 362.44482

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=CC2=CC3=CC=CC=C3N=C2SC)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C(=C/C2=CC3=CC=CC=C3N=C2SC)/C#N)OC

InChI

InChI=1S/C21H18N2O2S/c1-24-19-9-8-14(12-20(19)25-2)17(13-22)11-16-10-15-6-4-5-7-18(15)23-21(16)26-3/h4-12H,1-3H3/b17-11+