2-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-(4-methylpyridin-2-yl)quinazolin-4-one

Systemtic Name: 2-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-(4-methylpyridin-2-yl)quinazolin-4-one Openeye Name: 2-[(7-methoxy-2-oxo-chromen-4-yl)methylsulfanyl]-3-(4-methyl-2-pyridyl)quinazolin-4-one CAS Name: 2-[(7-methoxy-2-oxo-1-benzopyran-4-yl)methylthio]-3-(4-methyl-2-pyridinyl)-4-quinazolinone IUPAC Name: 2-[(7-methoxy-2-oxochromen-4-yl)methylsulfanyl]-3-(4-methylpyridin-2-yl)quinazolin-4-one Traditional Name: 2-[(2-keto-7-methoxy-chromen-4-yl)methylthio]-3-(4-methyl-2-pyridyl)quinazolin-4-one Formula: C25H19N3O4S MolecularWeight: 457.50106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=O)OC5=C4C=CC(=C5)OC

Isomeric SMILES

CC1=CC(=NC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=O)OC5=C4C=CC(=C5)OC

InChI

InChI=1S/C25H19N3O4S/c1-15-9-10-26-22(11-15)28-24(30)19-5-3-4-6-20(19)27-25(28)33-14-16-12-23(29)32-21-13-17(31-2)7-8-18(16)21/h3-13H,14H2,1-2H3