1-(5-chloranyl-2-methoxy-phenyl)-3-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]urea

Systemtic Name: 1-(5-chloranyl-2-methoxy-phenyl)-3-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]urea Openeye Name: 1-(5-chloro-2-methoxy-phenyl)-3-[2-(p-tolylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea CAS Name: 1-(5-chloro-2-methoxyphenyl)-3-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]urea IUPAC Name: 1-(5-chloro-2-methoxyphenyl)-3-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]urea Traditional Name: 1-(5-chloro-2-methoxy-phenyl)-3-(2-tosyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Formula: C24H24ClN3O4S MolecularWeight: 485.98306

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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=C(C=CC(=C4)Cl)OC

Isomeric SMILES

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

InChI

InChI=1S/C24H24ClN3O4S/c1-16-3-8-21(9-4-16)33(30,31)28-12-11-17-5-7-20(13-18(17)15-28)26-24(29)27-22-14-19(25)6-10-23(22)32-2/h3-10,13-14H,11-12,15H2,1-2H3,(H2,26,27,29)