3-(4-chlorophenyl)-6-iodanyl-2-[2-(3-methyl-5-oxidanylidene-4H-pyrazol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(4-chlorophenyl)-6-iodanyl-2-[2-(3-methyl-5-oxidanylidene-4H-pyrazol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-(4-chlorophenyl)-6-iodo-2-[2-(3-methyl-5-oxo-4H-pyrazol-1-yl)-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(4-chlorophenyl)-6-iodo-2-[[2-(3-methyl-5-oxo-4H-pyrazol-1-yl)-2-oxoethyl]thio]-4-quinazolinone IUPAC Name: 3-(4-chlorophenyl)-6-iodo-2-[2-(3-methyl-5-oxo-4H-pyrazol-1-yl)-2-oxoethyl]sulfanylquinazolin-4-one Traditional Name: 3-(4-chlorophenyl)-6-iodo-2-[[2-keto-2-(5-keto-3-methyl-2-pyrazolin-1-yl)ethyl]thio]quinazolin-4-one Formula: C20H14ClIN4O3S MolecularWeight: 552.77263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1)C(=O)CSC2=NC3=C(C=C(C=C3)I)C(=O)N2C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=NN(C(=O)C1)C(=O)CSC2=NC3=C(C=C(C=C3)I)C(=O)N2C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H14ClIN4O3S/c1-11-8-17(27)26(24-11)18(28)10-30-20-23-16-7-4-13(22)9-15(16)19(29)25(20)14-5-2-12(21)3-6-14/h2-7,9H,8,10H2,1H3