2-[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(2-methylpropyl)quinazolin-4-one

Systemtic Name: 2-[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(2-methylpropyl)quinazolin-4-one Openeye Name: 3-isobutyl-2-[2-(3-methoxyphenyl)-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 2-[[2-(3-methoxyphenyl)-2-oxoethyl]thio]-3-(2-methylpropyl)-4-quinazolinone IUPAC Name: 2-[2-(3-methoxyphenyl)-2-oxoethyl]sulfanyl-3-(2-methylpropyl)quinazolin-4-one Traditional Name: 3-isobutyl-2-[[2-keto-2-(3-methoxyphenyl)ethyl]thio]quinazolin-4-one Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CC(=CC=C3)OC

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C21H22N2O3S/c1-14(2)12-23-20(25)17-9-4-5-10-18(17)22-21(23)27-13-19(24)15-7-6-8-16(11-15)26-3/h4-11,14H,12-13H2,1-3H3