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

Systemtic Name: 5-[(2-bromophenyl)carbamoylamino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-propan-2-yl-benzamide Openeye Name: 5-[(2-bromophenyl)carbamoylamino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-isopropyl-benzamide CAS Name: 5-[[(2-bromoanilino)-oxomethyl]amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-propan-2-ylbenzamide IUPAC Name: 5-[(2-bromophenyl)carbamoylamino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-propan-2-ylbenzamide Traditional Name: 5-[(2-bromophenyl)carbamoylamino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-isopropyl-benzamide Formula: C26H27BrN4O2 MolecularWeight: 507.42218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=CC=C2Br)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=CC=C2Br)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C26H27BrN4O2/c1-17(2)28-25(32)21-15-20(29-26(33)30-23-10-6-5-9-22(23)27)11-12-24(21)31-14-13-18-7-3-4-8-19(18)16-31/h3-12,15,17H,13-14,16H2,1-2H3,(H,28,32)(H2,29,30,33)