N-(5-chloranyl-2-methyl-phenyl)-N-[[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]methyl]benzenesulfonamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-N-[[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]methyl]benzenesulfonamide Openeye Name: N-(5-chloro-2-methyl-phenyl)-N-[[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]methyl]benzenesulfonamide CAS Name: N-(5-chloro-2-methylphenyl)-N-[[4-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]phenyl]methyl]benzenesulfonamide IUPAC Name: N-(5-chloro-2-methylphenyl)-N-[[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]methyl]benzenesulfonamide Traditional Name: N-(5-chloro-2-methyl-phenyl)-N-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)benzyl]benzenesulfonamide Formula: C30H27ClN2O3S MolecularWeight: 531.06498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N(CC2=CC=C(C=C2)C(=O)N3CCC4=CC=CC=C4C3)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N(CC2=CC=C(C=C2)C(=O)N3CCC4=CC=CC=C4C3)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C30H27ClN2O3S/c1-22-11-16-27(31)19-29(22)33(37(35,36)28-9-3-2-4-10-28)20-23-12-14-25(15-13-23)30(34)32-18-17-24-7-5-6-8-26(24)21-32/h2-16,19H,17-18,20-21H2,1H3