N-[2-(4-chlorophenyl)ethyl]-6,7-dimethoxy-2-methyl-1-oxidanylidene-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-6,7-dimethoxy-2-methyl-1-oxidanylidene-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-6,7-dimethoxy-2-methyl-1-oxo-3-(2-thienyl)-3,4-dihydroisoquinoline-4-carboxamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-6,7-dimethoxy-2-methyl-1-oxo-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-6,7-dimethoxy-2-methyl-1-oxo-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-1-keto-6,7-dimethoxy-2-methyl-3-(2-thienyl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C25H25ClN2O4S MolecularWeight: 484.995

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NCCC3=CC=C(C=C3)Cl)C4=CC=CS4

Isomeric SMILES

CN1C(C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NCCC3=CC=C(C=C3)Cl)C4=CC=CS4

InChI

InChI=1S/C25H25ClN2O4S/c1-28-23(21-5-4-12-33-21)22(24(29)27-11-10-15-6-8-16(26)9-7-15)17-13-19(31-2)20(32-3)14-18(17)25(28)30/h4-9,12-14,22-23H,10-11H2,1-3H3,(H,27,29)