3,4-dihydro-1H-isoquinolin-2-yl-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-[(3,5-dimethyl-1-piperidyl)sulfonyl]phenyl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]phenyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-(3,5-dimethylpiperidino)sulfonylphenyl]methanone Formula: C23H28N2O3S MolecularWeight: 412.54502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCC4=CC=CC=C4C3)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCC4=CC=CC=C4C3)C

InChI

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