N-[4-[(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]phenyl]benzamide

Systemtic Name: N-[4-[(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]phenyl]benzamide Openeye Name: N-[4-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinoline-2-carbonyl]phenyl]benzamide CAS Name: N-[4-[(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]phenyl]benzamide IUPAC Name: N-[4-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]benzamide Traditional Name: N-[4-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinoline-2-carbonyl]phenyl]benzamide Formula: C29H26N2O4S MolecularWeight: 498.59274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4)C5=CC=CS5)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4)C5=CC=CS5)OC

InChI

InChI=1S/C29H26N2O4S/c1-34-24-17-21-14-15-31(27(26-9-6-16-36-26)23(21)18-25(24)35-2)29(33)20-10-12-22(13-11-20)30-28(32)19-7-4-3-5-8-19/h3-13,16-18,27H,14-15H2,1-2H3,(H,30,32)