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

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(2-methylpropanoylamino)-N-(2-morpholin-4-ylethyl)benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(2-methylpropanoylamino)-N-(2-morpholinoethyl)benzamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(2-methyl-1-oxopropyl)amino]-N-[2-(4-morpholinyl)ethyl]benzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(2-methylpropanoylamino)-N-(2-morpholin-4-ylethyl)benzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(isobutyrylamino)-N-(2-morpholinoethyl)benzamide Formula: C26H34N4O3 MolecularWeight: 450.57316

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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)NCCN4CCOCC4

Isomeric SMILES

CC(C)C(=O)NC1=CC(=C(C=C1)N2CCC3=CC=CC=C3C2)C(=O)NCCN4CCOCC4

InChI

InChI=1S/C26H34N4O3/c1-19(2)25(31)28-22-7-8-24(30-11-9-20-5-3-4-6-21(20)18-30)23(17-22)26(32)27-10-12-29-13-15-33-16-14-29/h3-8,17,19H,9-16,18H2,1-2H3,(H,27,32)(H,28,31)