N-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-butyl]thiophene-3-carboxamide

Systemtic Name: N-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-butyl]thiophene-3-carboxamide Openeye Name: N-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-butyl]thiophene-3-carboxamide CAS Name: N-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxobutyl]-3-thiophenecarboxamide IUPAC Name: N-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxobutyl]thiophene-3-carboxamide Traditional Name: N-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-keto-butyl]thiophene-3-carboxamide Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)CCCNC(=O)C3=CSC=C3)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)CCCNC(=O)C3=CSC=C3)OC

InChI

InChI=1S/C20H24N2O4S/c1-25-17-10-14-5-8-22(12-16(14)11-18(17)26-2)19(23)4-3-7-21-20(24)15-6-9-27-13-15/h6,9-11,13H,3-5,7-8,12H2,1-2H3,(H,21,24)