N-(5-chloranyl-2-methyl-phenyl)-N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-butyl]methanesulfonamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-butyl]methanesulfonamide Openeye Name: N-(5-chloro-2-methyl-phenyl)-N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-butyl]methanesulfonamide CAS Name: N-(5-chloro-2-methylphenyl)-N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxobutyl]methanesulfonamide IUPAC Name: N-(5-chloro-2-methylphenyl)-N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxobutyl]methanesulfonamide Traditional Name: N-(5-chloro-2-methyl-phenyl)-N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-keto-butyl]methanesulfonamide Formula: C21H25ClN2O3S MolecularWeight: 420.9528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N(CCCC(=O)N2CCC3=CC=CC=C3C2)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N(CCCC(=O)N2CCC3=CC=CC=C3C2)S(=O)(=O)C

InChI

InChI=1S/C21H25ClN2O3S/c1-16-9-10-19(22)14-20(16)24(28(2,26)27)12-5-8-21(25)23-13-11-17-6-3-4-7-18(17)15-23/h3-4,6-7,9-10,14H,5,8,11-13,15H2,1-2H3