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

Systemtic Name: 2-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(3-methoxypropyl)quinazolin-4-one Openeye Name: 2-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-3-(3-methoxypropyl)quinazolin-4-one CAS Name: 2-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-3-(3-methoxypropyl)-4-quinazolinone IUPAC Name: 2-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-3-(3-methoxypropyl)quinazolin-4-one Traditional Name: 2-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-3-(3-methoxypropyl)quinazolin-4-one Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

COCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H22N2O4S/c1-26-13-5-12-23-20(25)17-6-3-4-7-18(17)22-21(23)28-14-19(24)15-8-10-16(27-2)11-9-15/h3-4,6-11H,5,12-14H2,1-2H3