2-[2-(5-chloranylthiophen-2-yl)-2-oxidanylidene-ethyl]sulfanyl-3-(4-methoxyphenyl)quinazolin-4-one

Systemtic Name: 2-[2-(5-chloranylthiophen-2-yl)-2-oxidanylidene-ethyl]sulfanyl-3-(4-methoxyphenyl)quinazolin-4-one Openeye Name: 2-[2-(5-chloro-2-thienyl)-2-oxo-ethyl]sulfanyl-3-(4-methoxyphenyl)quinazolin-4-one CAS Name: 2-[[2-(5-chloro-2-thiophenyl)-2-oxoethyl]thio]-3-(4-methoxyphenyl)-4-quinazolinone IUPAC Name: 2-[2-(5-chlorothiophen-2-yl)-2-oxoethyl]sulfanyl-3-(4-methoxyphenyl)quinazolin-4-one Traditional Name: 2-[[2-(5-chloro-2-thienyl)-2-keto-ethyl]thio]-3-(4-methoxyphenyl)quinazolin-4-one Formula: C21H15ClN2O3S2 MolecularWeight: 442.9384

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(S4)Cl

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C21H15ClN2O3S2/c1-27-14-8-6-13(7-9-14)24-20(26)15-4-2-3-5-16(15)23-21(24)28-12-17(25)18-10-11-19(22)29-18/h2-11H,12H2,1H3