4-chloranyl-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[(1R,2S)-2-methylcyclohexyl]benzamide

Systemtic Name: 4-chloranyl-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[(1R,2S)-2-methylcyclohexyl]benzamide Openeye Name: 4-chloro-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[(1R,2S)-2-methylcyclohexyl]benzamide CAS Name: 4-chloro-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[(1R,2S)-2-methylcyclohexyl]benzamide IUPAC Name: 4-chloro-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[(1R,2S)-2-methylcyclohexyl]benzamide Traditional Name: 4-chloro-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[(1R,2S)-2-methylcyclohexyl]benzamide Formula: C23H27ClN2O3S MolecularWeight: 446.99008

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

C[C@H]1CCCC[C@H]1NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H27ClN2O3S/c1-16-6-2-5-9-21(16)25-23(27)18-10-11-20(24)22(14-18)30(28,29)26-13-12-17-7-3-4-8-19(17)15-26/h3-4,7-8,10-11,14,16,21H,2,5-6,9,12-13,15H2,1H3,(H,25,27)/t16-,21+/m0/s1