5-(cyclohexylcarbamoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-methylpropyl)benzamide

Systemtic Name: 5-(cyclohexylcarbamoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-methylpropyl)benzamide Openeye Name: 5-(cyclohexylcarbamoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-isobutyl-benzamide CAS Name: 5-[[(cyclohexylamino)-oxomethyl]amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-methylpropyl)benzamide IUPAC Name: 5-(cyclohexylcarbamoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-methylpropyl)benzamide Traditional Name: 5-(cyclohexylcarbamoylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-isobutyl-benzamide Formula: C27H36N4O2 MolecularWeight: 448.60034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=C(C=CC(=C1)NC(=O)NC2CCCCC2)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC(C)CNC(=O)C1=C(C=CC(=C1)NC(=O)NC2CCCCC2)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C27H36N4O2/c1-19(2)17-28-26(32)24-16-23(30-27(33)29-22-10-4-3-5-11-22)12-13-25(24)31-15-14-20-8-6-7-9-21(20)18-31/h6-9,12-13,16,19,22H,3-5,10-11,14-15,17-18H2,1-2H3,(H,28,32)(H2,29,30,33)