1-(3,4-dichlorophenyl)-3-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]urea

Systemtic Name: 1-(3,4-dichlorophenyl)-3-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]urea Openeye Name: 1-(3,4-dichlorophenyl)-3-[2-(p-tolylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea CAS Name: 1-(3,4-dichlorophenyl)-3-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]urea IUPAC Name: 1-(3,4-dichlorophenyl)-3-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]urea Traditional Name: 1-(3,4-dichlorophenyl)-3-(2-tosyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Formula: C23H21Cl2N3O3S MolecularWeight: 490.40214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)NC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)NC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C23H21Cl2N3O3S/c1-15-2-7-20(8-3-15)32(30,31)28-11-10-16-4-5-18(12-17(16)14-28)26-23(29)27-19-6-9-21(24)22(25)13-19/h2-9,12-13H,10-11,14H2,1H3,(H2,26,27,29)