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

Systemtic Name: 1-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[2-(p-tolylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea CAS Name: 1-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]urea Traditional Name: 1-benzyl-3-(2-tosyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Formula: C24H25N3O3S MolecularWeight: 435.5386

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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)NCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C24H25N3O3S/c1-18-7-11-23(12-8-18)31(29,30)27-14-13-20-9-10-22(15-21(20)17-27)26-24(28)25-16-19-5-3-2-4-6-19/h2-12,15H,13-14,16-17H2,1H3,(H2,25,26,28)