N-(2-methylcyclohexyl)-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-(2-methylcyclohexyl)-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-(2-methylcyclohexyl)-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-(2-methylcyclohexyl)-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-(2-methylcyclohexyl)-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-mesyl-N-(2-methylcyclohexyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C18H26N2O3S MolecularWeight: 350.47564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C2CC3=CC=CC=C3CN2S(=O)(=O)C

Isomeric SMILES

CC1CCCCC1NC(=O)C2CC3=CC=CC=C3CN2S(=O)(=O)C

InChI

InChI=1S/C18H26N2O3S/c1-13-7-3-6-10-16(13)19-18(21)17-11-14-8-4-5-9-15(14)12-20(17)24(2,22)23/h4-5,8-9,13,16-17H,3,6-7,10-12H2,1-2H3,(H,19,21)