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

Systemtic Name: 1-[(4-methoxyphenyl)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-[(4-methoxyphenyl)methyl]urea CAS Name: 1-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-[(4-methoxyphenyl)methyl]urea IUPAC Name: 1-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-[(4-methoxyphenyl)methyl]urea Traditional Name: 1-(2-besyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-p-anisyl-urea Formula: C24H25N3O4S MolecularWeight: 451.538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H25N3O4S/c1-31-22-11-7-18(8-12-22)16-25-24(28)26-21-10-9-19-13-14-27(17-20(19)15-21)32(29,30)23-5-3-2-4-6-23/h2-12,15H,13-14,16-17H2,1H3,(H2,25,26,28)