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

Systemtic Name: 5-[(3-chloranyl-4-fluoranyl-phenyl)carbamoylamino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-propan-2-yl-benzamide Openeye Name: 5-[(3-chloro-4-fluoro-phenyl)carbamoylamino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-isopropyl-benzamide CAS Name: 5-[[(3-chloro-4-fluoroanilino)-oxomethyl]amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-propan-2-ylbenzamide IUPAC Name: 5-[(3-chloro-4-fluorophenyl)carbamoylamino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-propan-2-ylbenzamide Traditional Name: 5-[(3-chloro-4-fluoro-phenyl)carbamoylamino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-isopropyl-benzamide Formula: C26H26ClFN4O2 MolecularWeight: 480.961643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC(=C(C=C2)F)Cl)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC(=C(C=C2)F)Cl)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C26H26ClFN4O2/c1-16(2)29-25(33)21-13-19(30-26(34)31-20-7-9-23(28)22(27)14-20)8-10-24(21)32-12-11-17-5-3-4-6-18(17)15-32/h3-10,13-14,16H,11-12,15H2,1-2H3,(H,29,33)(H2,30,31,34)