3-[3-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]-2-methyl-quinazolin-4-one

Systemtic Name: 3-[3-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]-2-methyl-quinazolin-4-one Openeye Name: 3-[3-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-oxo-propyl]-2-methyl-quinazolin-4-one CAS Name: 3-[3-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-2-methyl-4-quinazolinone IUPAC Name: 3-[3-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-2-methylquinazolin-4-one Traditional Name: 3-[3-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-keto-propyl]-2-methyl-quinazolin-4-one Formula: C27H27N3O4S MolecularWeight: 489.58598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1CCC(=O)N3CCC4=CC(=C(C=C4C3C5=CC=CS5)OC)OC

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1CCC(=O)N3CCC4=CC(=C(C=C4C3C5=CC=CS5)OC)OC

InChI

InChI=1S/C27H27N3O4S/c1-17-28-21-8-5-4-7-19(21)27(32)29(17)13-11-25(31)30-12-10-18-15-22(33-2)23(34-3)16-20(18)26(30)24-9-6-14-35-24/h4-9,14-16,26H,10-13H2,1-3H3