3-butyl-2-[2-(2,5-dimethylthiophen-3-yl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-butyl-2-[2-(2,5-dimethylthiophen-3-yl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-butyl-2-[2-(2,5-dimethyl-3-thienyl)-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-butyl-2-[[2-(2,5-dimethyl-3-thiophenyl)-2-oxoethyl]thio]-4-quinazolinone IUPAC Name: 3-butyl-2-[2-(2,5-dimethylthiophen-3-yl)-2-oxoethyl]sulfanylquinazolin-4-one Traditional Name: 3-butyl-2-[[2-(2,5-dimethyl-3-thienyl)-2-keto-ethyl]thio]quinazolin-4-one Formula: C20H22N2O2S2 MolecularWeight: 386.53088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=C(SC(=C3)C)C

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=C(SC(=C3)C)C

InChI

InChI=1S/C20H22N2O2S2/c1-4-5-10-22-19(24)15-8-6-7-9-17(15)21-20(22)25-12-18(23)16-11-13(2)26-14(16)3/h6-9,11H,4-5,10,12H2,1-3H3