N-[3-cyano-4-(3,4-dimethoxyphenyl)thiophen-2-yl]-2-phenylsulfanyl-ethanamide

Systemtic Name: N-[3-cyano-4-(3,4-dimethoxyphenyl)thiophen-2-yl]-2-phenylsulfanyl-ethanamide Openeye Name: N-[3-cyano-4-(3,4-dimethoxyphenyl)-2-thienyl]-2-phenylsulfanyl-acetamide CAS Name: N-[3-cyano-4-(3,4-dimethoxyphenyl)-2-thiophenyl]-2-(phenylthio)acetamide IUPAC Name: N-[3-cyano-4-(3,4-dimethoxyphenyl)thiophen-2-yl]-2-phenylsulfanylacetamide Traditional Name: N-[3-cyano-4-(3,4-dimethoxyphenyl)-2-thienyl]-2-(phenylthio)acetamide Formula: C21H18N2O3S2 MolecularWeight: 410.50922

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=C2C#N)NC(=O)CSC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=C2C#N)NC(=O)CSC3=CC=CC=C3)OC

InChI

InChI=1S/C21H18N2O3S2/c1-25-18-9-8-14(10-19(18)26-2)17-12-28-21(16(17)11-22)23-20(24)13-27-15-6-4-3-5-7-15/h3-10,12H,13H2,1-2H3,(H,23,24)