N-cyclohexyl-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-cyclohexyl-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-cyclohexyl-2-(p-tolylsulfonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-cyclohexyl-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-cyclohexyl-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-cyclohexyl-2-tosyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C23H28N2O3S MolecularWeight: 412.54502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)NC4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)NC4CCCCC4

InChI

InChI=1S/C23H28N2O3S/c1-17-11-13-21(14-12-17)29(27,28)25-16-19-8-6-5-7-18(19)15-22(25)23(26)24-20-9-3-2-4-10-20/h5-8,11-14,20,22H,2-4,9-10,15-16H2,1H3,(H,24,26)