N-[(3,4-dimethoxyphenyl)methyl]-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(1-pyrrolyl)-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxamide Traditional Name: 2-pyrrol-1-yl-N-veratryl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxamide Formula: C21H22N2O3S2 MolecularWeight: 414.54098

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=C(SC3=C2CCSC3)N4C=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=C(SC3=C2CCSC3)N4C=CC=C4)OC

InChI

InChI=1S/C21H22N2O3S2/c1-25-16-6-5-14(11-17(16)26-2)12-22-20(24)19-15-7-10-27-13-18(15)28-21(19)23-8-3-4-9-23/h3-6,8-9,11H,7,10,12-13H2,1-2H3,(H,22,24)