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

Systemtic Name: 5-[(3-chloranyl-4-methyl-phenyl)carbamoylamino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-propan-2-yl-benzamide Openeye Name: 5-[(3-chloro-4-methyl-phenyl)carbamoylamino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-isopropyl-benzamide CAS Name: 5-[[(3-chloro-4-methylanilino)-oxomethyl]amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-propan-2-ylbenzamide IUPAC Name: 5-[(3-chloro-4-methylphenyl)carbamoylamino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-propan-2-ylbenzamide Traditional Name: 5-[(3-chloro-4-methyl-phenyl)carbamoylamino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-isopropyl-benzamide Formula: C27H29ClN4O2 MolecularWeight: 476.99776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC2=CC(=C(C=C2)N3CCC4=CC=CC=C4C3)C(=O)NC(C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC2=CC(=C(C=C2)N3CCC4=CC=CC=C4C3)C(=O)NC(C)C)Cl

InChI

InChI=1S/C27H29ClN4O2/c1-17(2)29-26(33)23-14-21(30-27(34)31-22-9-8-18(3)24(28)15-22)10-11-25(23)32-13-12-19-6-4-5-7-20(19)16-32/h4-11,14-15,17H,12-13,16H2,1-3H3,(H,29,33)(H2,30,31,34)