(4-methoxyphenyl)-(6-methoxy-7-phenylmethoxy-4-phenylsulfanyl-3,4-dihydro-1H-isoquinolin-2-yl)methanone

Systemtic Name: (4-methoxyphenyl)-(6-methoxy-7-phenylmethoxy-4-phenylsulfanyl-3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: (7-benzyloxy-6-methoxy-4-phenylsulfanyl-3,4-dihydro-1H-isoquinolin-2-yl)-(4-methoxyphenyl)methanone CAS Name: (4-methoxyphenyl)-[6-methoxy-7-phenylmethoxy-4-(phenylthio)-3,4-dihydro-1H-isoquinolin-2-yl]methanone IUPAC Name: (4-methoxyphenyl)-(6-methoxy-7-phenylmethoxy-4-phenylsulfanyl-3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: [7-benzoxy-6-methoxy-4-(phenylthio)-3,4-dihydro-1H-isoquinolin-2-yl]-(4-methoxyphenyl)methanone Formula: C31H29NO4S MolecularWeight: 511.63126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N2CC(C3=CC(=C(C=C3C2)OCC4=CC=CC=C4)OC)SC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N2CC(C3=CC(=C(C=C3C2)OCC4=CC=CC=C4)OC)SC5=CC=CC=C5

InChI

InChI=1S/C31H29NO4S/c1-34-25-15-13-23(14-16-25)31(33)32-19-24-17-29(36-21-22-9-5-3-6-10-22)28(35-2)18-27(24)30(20-32)37-26-11-7-4-8-12-26/h3-18,30H,19-21H2,1-2H3