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

Systemtic Name: 5-[(4-chlorophenyl)carbamoylamino]-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide Openeye Name: 5-[(4-chlorophenyl)carbamoylamino]-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide CAS Name: 5-[[(4-chloroanilino)-oxomethyl]amino]-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide IUPAC Name: 5-[(4-chlorophenyl)carbamoylamino]-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide Traditional Name: 5-[(4-chlorophenyl)carbamoylamino]-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide Formula: C26H25ClN4O2 MolecularWeight: 460.9553

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=C(C=CC(=C2)NC(=O)NC3=CC=C(C=C3)Cl)N4CCC5=CC=CC=C5C4

Isomeric SMILES

C1CC1NC(=O)C2=C(C=CC(=C2)NC(=O)NC3=CC=C(C=C3)Cl)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C26H25ClN4O2/c27-19-5-7-21(8-6-19)29-26(33)30-22-11-12-24(23(15-22)25(32)28-20-9-10-20)31-14-13-17-3-1-2-4-18(17)16-31/h1-8,11-12,15,20H,9-10,13-14,16H2,(H,28,32)(H2,29,30,33)