(Z)-3-(2-chloranyl-3,4-dimethoxy-phenyl)-2-cyano-prop-2-enethioamide

Systemtic Name: (Z)-3-(2-chloranyl-3,4-dimethoxy-phenyl)-2-cyano-prop-2-enethioamide Openeye Name: (Z)-3-(2-chloro-3,4-dimethoxy-phenyl)-2-cyano-prop-2-enethioamide CAS Name: (Z)-3-(2-chloro-3,4-dimethoxyphenyl)-2-cyano-2-propenethioamide IUPAC Name: (Z)-3-(2-chloro-3,4-dimethoxyphenyl)-2-cyanoprop-2-enethioamide Traditional Name: (Z)-3-(2-chloro-3,4-dimethoxy-phenyl)-2-cyano-thioacrylamide Formula: C12H11ClN2O2S MolecularWeight: 282.74594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C=C(C#N)C(=S)N)Cl)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)/C=C(/C#N)\C(=S)N)Cl)OC

InChI

InChI=1S/C12H11ClN2O2S/c1-16-9-4-3-7(10(13)11(9)17-2)5-8(6-14)12(15)18/h3-5H,1-2H3,(H2,15,18)/b8-5-