N-[(4-cyanophenyl)carbamoyl]-2-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)ethanamide

Systemtic Name: N-[(4-cyanophenyl)carbamoyl]-2-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)ethanamide Openeye Name: N-[(4-cyanophenyl)carbamoyl]-2-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]acetamide CAS Name: N-[(4-cyanoanilino)-oxomethyl]-2-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)acetamide IUPAC Name: N-[(4-cyanophenyl)carbamoyl]-2-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)acetamide Traditional Name: N-[(4-cyanophenyl)carbamoyl]-2-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]acetamide Formula: C25H24N4O4S MolecularWeight: 476.54746

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)CC(=O)NC(=O)NC3=CC=C(C=C3)C#N)C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)CC(=O)NC(=O)NC3=CC=C(C=C3)C#N)C4=CC=CS4)OC

InChI

InChI=1S/C25H24N4O4S/c1-32-20-12-17-9-10-29(24(22-4-3-11-34-22)19(17)13-21(20)33-2)15-23(30)28-25(31)27-18-7-5-16(14-26)6-8-18/h3-8,11-13,24H,9-10,15H2,1-2H3,(H2,27,28,30,31)