N-[5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-2,3-dimethoxy-phenyl]thiophene-2-carboxamide

Systemtic Name: N-[5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-2,3-dimethoxy-phenyl]thiophene-2-carboxamide Openeye Name: N-[5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2,3-dimethoxy-phenyl]thiophene-2-carboxamide CAS Name: N-[5-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-2,3-dimethoxyphenyl]-2-thiophenecarboxamide IUPAC Name: N-[5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2,3-dimethoxyphenyl]thiophene-2-carboxamide Traditional Name: N-[5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2,3-dimethoxy-phenyl]thiophene-2-carboxamide Formula: C23H22N2O4S MolecularWeight: 422.49678

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)NC(=O)C2=CC=CS2)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)NC(=O)C2=CC=CS2)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H22N2O4S/c1-28-19-13-17(23(27)25-10-9-15-6-3-4-7-16(15)14-25)12-18(21(19)29-2)24-22(26)20-8-5-11-30-20/h3-8,11-13H,9-10,14H2,1-2H3,(H,24,26)