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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC(C)C

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC(C)C

InChI

InChI=1S/C20H22N2O2S2/c1-12(2)10-22-19(24)15-7-5-6-8-17(15)21-20(22)25-11-18(23)16-9-13(3)26-14(16)4/h5-9,12H,10-11H2,1-4H3