2-[7-chloranyl-6-methoxy-1-(2-pyridin-4-ylethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-6,7-dimethoxy-1H-quinazolin-4-one

Systemtic Name: 2-[7-chloranyl-6-methoxy-1-(2-pyridin-4-ylethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-6,7-dimethoxy-1H-quinazolin-4-one Openeye Name: 2-[7-chloro-6-methoxy-1-[2-(4-pyridyl)ethyl]-3,4-dihydro-1H-isoquinolin-2-yl]-6,7-dimethoxy-1H-quinazolin-4-one CAS Name: 2-[7-chloro-6-methoxy-1-(2-pyridin-4-ylethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-6,7-dimethoxy-1H-quinazolin-4-one IUPAC Name: 2-[7-chloro-6-methoxy-1-(2-pyridin-4-ylethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-6,7-dimethoxy-1H-quinazolin-4-one Traditional Name: 2-[7-chloro-6-methoxy-1-[2-(4-pyridyl)ethyl]-3,4-dihydro-1H-isoquinolin-2-yl]-6,7-dimethoxy-1H-quinazolin-4-one Formula: C27H27ClN4O4 MolecularWeight: 506.98068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C3=NC(=O)C4=CC(=C(C=C4N3)OC)OC)CCC5=CC=NC=C5)Cl

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C3=NC(=O)C4=CC(=C(C=C4N3)OC)OC)CCC5=CC=NC=C5)Cl

InChI

InChI=1S/C27H27ClN4O4/c1-34-23-12-17-8-11-32(22(18(17)13-20(23)28)5-4-16-6-9-29-10-7-16)27-30-21-15-25(36-3)24(35-2)14-19(21)26(33)31-27/h6-7,9-10,12-15,22H,4-5,8,11H2,1-3H3,(H,30,31,33)