3-(2-chloranyl-4,5-dimethoxy-phenyl)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)prop-2-enamide

Systemtic Name: 3-(2-chloranyl-4,5-dimethoxy-phenyl)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)prop-2-enamide Openeye Name: 3-(2-chloro-4,5-dimethoxy-phenyl)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)prop-2-enamide CAS Name: 3-(2-chloro-4,5-dimethoxyphenyl)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-propenamide IUPAC Name: 3-(2-chloro-4,5-dimethoxyphenyl)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)prop-2-enamide Traditional Name: 3-(2-chloro-4,5-dimethoxy-phenyl)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)acrylamide Formula: C21H18ClN3O3S MolecularWeight: 427.90392

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=C(C#N)C(=O)NC2=C(C3=C(S2)CCCC3)C#N)Cl)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C=C(C#N)C(=O)NC2=C(C3=C(S2)CCCC3)C#N)Cl)OC

InChI

InChI=1S/C21H18ClN3O3S/c1-27-17-8-12(16(22)9-18(17)28-2)7-13(10-23)20(26)25-21-15(11-24)14-5-3-4-6-19(14)29-21/h7-9H,3-6H2,1-2H3,(H,25,26)