2-chloranyl-N-[2-[(2-methoxypyrimidin-5-yl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]benzamide

Systemtic Name: 2-chloranyl-N-[2-[(2-methoxypyrimidin-5-yl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]benzamide Openeye Name: 2-chloro-N-[2-[(2-methoxypyrimidin-5-yl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]benzamide CAS Name: 2-chloro-N-[2-[(2-methoxy-5-pyrimidinyl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]benzamide IUPAC Name: 2-chloro-N-[2-[(2-methoxypyrimidin-5-yl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]benzamide Traditional Name: 2-chloro-N-[2-[(2-methoxypyrimidin-5-yl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]benzamide Formula: C22H21ClN4O2 MolecularWeight: 408.88074

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=N1)CN2CCC3=C(C2)C=C(C=C3)NC(=O)C4=CC=CC=C4Cl

Isomeric SMILES

COC1=NC=C(C=N1)CN2CCC3=C(C2)C=C(C=C3)NC(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C22H21ClN4O2/c1-29-22-24-11-15(12-25-22)13-27-9-8-16-6-7-18(10-17(16)14-27)26-21(28)19-4-2-3-5-20(19)23/h2-7,10-12H,8-9,13-14H2,1H3,(H,26,28)