2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-phenylsulfanylphenyl)ethanamide

Systemtic Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-phenylsulfanylphenyl)ethanamide Openeye Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-phenylsulfanylphenyl)acetamide CAS Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-[2-(phenylthio)phenyl]acetamide IUPAC Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-phenylsulfanylphenyl)acetamide Traditional Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-[2-(phenylthio)phenyl]acetamide Formula: C25H26N2O3S MolecularWeight: 434.55054

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CC(=O)NC3=CC=CC=C3SC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)CC(=O)NC3=CC=CC=C3SC4=CC=CC=C4)OC

InChI

InChI=1S/C25H26N2O3S/c1-29-22-14-18-12-13-27(16-19(18)15-23(22)30-2)17-25(28)26-21-10-6-7-11-24(21)31-20-8-4-3-5-9-20/h3-11,14-15H,12-13,16-17H2,1-2H3,(H,26,28)