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

Systemtic Name: 5-[(3-chloranyl-4-fluoranyl-phenyl)carbamoylamino]-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide Openeye Name: 5-[(3-chloro-4-fluoro-phenyl)carbamoylamino]-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide CAS Name: 5-[[(3-chloro-4-fluoroanilino)-oxomethyl]amino]-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide IUPAC Name: 5-[(3-chloro-4-fluorophenyl)carbamoylamino]-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide Traditional Name: 5-[(3-chloro-4-fluoro-phenyl)carbamoylamino]-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide Formula: C26H24ClFN4O2 MolecularWeight: 478.945763

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H24ClFN4O2/c27-22-14-20(7-9-23(22)28)31-26(34)30-19-8-10-24(21(13-19)25(33)29-18-5-6-18)32-12-11-16-3-1-2-4-17(16)15-32/h1-4,7-10,13-14,18H,5-6,11-12,15H2,(H,29,33)(H2,30,31,34)