2-chloranyl-N-[2-(2,6-dimethylpyrimidin-4-yl)carbonyl-3,4-dihydro-1H-isoquinolin-7-yl]benzamide

Systemtic Name: 2-chloranyl-N-[2-(2,6-dimethylpyrimidin-4-yl)carbonyl-3,4-dihydro-1H-isoquinolin-7-yl]benzamide Openeye Name: 2-chloro-N-[2-(2,6-dimethylpyrimidine-4-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide CAS Name: 2-chloro-N-[2-[(2,6-dimethyl-4-pyrimidinyl)-oxomethyl]-3,4-dihydro-1H-isoquinolin-7-yl]benzamide IUPAC Name: 2-chloro-N-[2-(2,6-dimethylpyrimidine-4-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide Traditional Name: 2-chloro-N-[2-(2,6-dimethylpyrimidine-4-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide Formula: C23H21ClN4O2 MolecularWeight: 420.89144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)C4=CC=CC=C4Cl)C

Isomeric SMILES

CC1=NC(=NC(=C1)C(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)C4=CC=CC=C4Cl)C

InChI

InChI=1S/C23H21ClN4O2/c1-14-11-21(26-15(2)25-14)23(30)28-10-9-16-7-8-18(12-17(16)13-28)27-22(29)19-5-3-4-6-20(19)24/h3-8,11-12H,9-10,13H2,1-2H3,(H,27,29)