(3S)-N-(2,4-dichlorophenyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3S)-N-(2,4-dichlorophenyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3S)-N-(2,4-dichlorophenyl)-2-(p-tolylsulfonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3S)-N-(2,4-dichlorophenyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3S)-N-(2,4-dichlorophenyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3S)-N-(2,4-dichlorophenyl)-2-tosyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C23H20Cl2N2O3S MolecularWeight: 475.3875

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)NC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=CC=CC=C3C[C@H]2C(=O)NC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C23H20Cl2N2O3S/c1-15-6-9-19(10-7-15)31(29,30)27-14-17-5-3-2-4-16(17)12-22(27)23(28)26-21-11-8-18(24)13-20(21)25/h2-11,13,22H,12,14H2,1H3,(H,26,28)/t22-/m0/s1