3,4-dihydro-1H-isoquinolin-2-yl-[1-(2,4-dimethylphenyl)sulfonylpiperidin-4-yl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(2,4-dimethylphenyl)sulfonylpiperidin-4-yl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(2,4-dimethylphenyl)sulfonyl-4-piperidyl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(2,4-dimethylphenyl)sulfonyl-4-piperidinyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(2,4-dimethylphenyl)sulfonylpiperidin-4-yl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(2,4-dimethylphenyl)sulfonyl-4-piperidyl]methanone Formula: C23H28N2O3S MolecularWeight: 412.54502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCC4=CC=CC=C4C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCC4=CC=CC=C4C3)C

InChI

InChI=1S/C23H28N2O3S/c1-17-7-8-22(18(2)15-17)29(27,28)25-13-10-20(11-14-25)23(26)24-12-9-19-5-3-4-6-21(19)16-24/h3-8,15,20H,9-14,16H2,1-2H3