N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(2-methylphenyl)carbamoylamino]benzamide

Systemtic Name: N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(2-methylphenyl)carbamoylamino]benzamide Openeye Name: N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(o-tolylcarbamoylamino)benzamide CAS Name: N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[[(2-methylanilino)-oxomethyl]amino]benzamide IUPAC Name: N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(2-methylphenyl)carbamoylamino]benzamide Traditional Name: N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(o-tolylcarbamoylamino)benzamide Formula: C27H28N4O2 MolecularWeight: 440.53682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NC2=CC(=C(C=C2)N3CCC4=CC=CC=C4C3)C(=O)NC5CC5

Isomeric SMILES

CC1=CC=CC=C1NC(=O)NC2=CC(=C(C=C2)N3CCC4=CC=CC=C4C3)C(=O)NC5CC5

InChI

InChI=1S/C27H28N4O2/c1-18-6-2-5-9-24(18)30-27(33)29-22-12-13-25(23(16-22)26(32)28-21-10-11-21)31-15-14-19-7-3-4-8-20(19)17-31/h2-9,12-13,16,21H,10-11,14-15,17H2,1H3,(H,28,32)(H2,29,30,33)