2-[(7-ethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-(2-methylpropyl)quinazolin-4-one

Systemtic Name: 2-[(7-ethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-(2-methylpropyl)quinazolin-4-one Openeye Name: 2-[(7-ethyl-2-oxo-chromen-4-yl)methylsulfanyl]-3-isobutyl-quinazolin-4-one CAS Name: 2-[(7-ethyl-2-oxo-1-benzopyran-4-yl)methylthio]-3-(2-methylpropyl)-4-quinazolinone IUPAC Name: 2-[(7-ethyl-2-oxochromen-4-yl)methylsulfanyl]-3-(2-methylpropyl)quinazolin-4-one Traditional Name: 2-[(7-ethyl-2-keto-chromen-4-yl)methylthio]-3-isobutyl-quinazolin-4-one Formula: C24H24N2O3S MolecularWeight: 420.52396

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=CC=CC=C4C(=O)N3CC(C)C

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=CC=CC=C4C(=O)N3CC(C)C

InChI

InChI=1S/C24H24N2O3S/c1-4-16-9-10-18-17(12-22(27)29-21(18)11-16)14-30-24-25-20-8-6-5-7-19(20)23(28)26(24)13-15(2)3/h5-12,15H,4,13-14H2,1-3H3