N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(2-methylpropanoylamino)benzamide

Systemtic Name: N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(2-methylpropanoylamino)benzamide Openeye Name: N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(2-methylpropanoylamino)benzamide CAS Name: N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(2-methyl-1-oxopropyl)amino]benzamide IUPAC Name: N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(2-methylpropanoylamino)benzamide Traditional Name: N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(isobutyrylamino)benzamide Formula: C26H33N3O2 MolecularWeight: 419.55912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC(=C(C=C1)N2CCC3=CC=CC=C3C2)C(=O)NC4CCCCC4

Isomeric SMILES

CC(C)C(=O)NC1=CC(=C(C=C1)N2CCC3=CC=CC=C3C2)C(=O)NC4CCCCC4

InChI

InChI=1S/C26H33N3O2/c1-18(2)25(30)28-22-12-13-24(29-15-14-19-8-6-7-9-20(19)17-29)23(16-22)26(31)27-21-10-4-3-5-11-21/h6-9,12-13,16,18,21H,3-5,10-11,14-15,17H2,1-2H3,(H,27,31)(H,28,30)