1-[(3,4-dimethoxyphenyl)methyl]-3-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea

Systemtic Name: 1-[(3,4-dimethoxyphenyl)methyl]-3-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea Openeye Name: 1-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-[(3,4-dimethoxyphenyl)methyl]urea CAS Name: 1-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-[(3,4-dimethoxyphenyl)methyl]urea IUPAC Name: 1-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-[(3,4-dimethoxyphenyl)methyl]urea Traditional Name: 1-(2-besyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-veratryl-urea Formula: C25H27N3O5S MolecularWeight: 481.56398

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)NC2=CC3=C(CCN(C3)S(=O)(=O)C4=CC=CC=C4)C=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)NC2=CC3=C(CCN(C3)S(=O)(=O)C4=CC=CC=C4)C=C2)OC

InChI

InChI=1S/C25H27N3O5S/c1-32-23-11-8-18(14-24(23)33-2)16-26-25(29)27-21-10-9-19-12-13-28(17-20(19)15-21)34(30,31)22-6-4-3-5-7-22/h3-11,14-15H,12-13,16-17H2,1-2H3,(H2,26,27,29)