2-[2-[2,4-bis(oxidanyl)phenyl]-2-oxidanylidene-ethyl]sulfanyl-7-chloranyl-3-cyclopentyl-quinazolin-4-one

Systemtic Name: 2-[2-[2,4-bis(oxidanyl)phenyl]-2-oxidanylidene-ethyl]sulfanyl-7-chloranyl-3-cyclopentyl-quinazolin-4-one Openeye Name: 7-chloro-3-cyclopentyl-2-[2-(2,4-dihydroxyphenyl)-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 7-chloro-3-cyclopentyl-2-[[2-(2,4-dihydroxyphenyl)-2-oxoethyl]thio]-4-quinazolinone IUPAC Name: 7-chloro-3-cyclopentyl-2-[2-(2,4-dihydroxyphenyl)-2-oxoethyl]sulfanylquinazolin-4-one Traditional Name: 7-chloro-3-cyclopentyl-2-[[2-(2,4-dihydroxyphenyl)-2-keto-ethyl]thio]quinazolin-4-one Formula: C21H19ClN2O4S MolecularWeight: 430.90456

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)C4=C(C=C(C=C4)O)O

Isomeric SMILES

C1CCC(C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)C4=C(C=C(C=C4)O)O

InChI

InChI=1S/C21H19ClN2O4S/c22-12-5-7-15-17(9-12)23-21(24(20(15)28)13-3-1-2-4-13)29-11-19(27)16-8-6-14(25)10-18(16)26/h5-10,13,25-26H,1-4,11H2