6,8-bis(chloranyl)-3-(3-methylbutanoyl)-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 6,8-bis(chloranyl)-3-(3-methylbutanoyl)-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 6,8-dichloro-3-(3-methylbutanoyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 6,8-dichloro-3-(3-methyl-1-oxobutyl)-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 6,8-dichloro-3-(3-methylbutanoyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 6,8-dichloro-3-isovaleryl-2-thioxo-1H-quinazolin-4-one Formula: C13H12Cl2N2O2S MolecularWeight: 331.21758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1C(=O)C2=CC(=CC(=C2NC1=S)Cl)Cl

Isomeric SMILES

CC(C)CC(=O)N1C(=O)C2=CC(=CC(=C2NC1=S)Cl)Cl

InChI

InChI=1S/C13H12Cl2N2O2S/c1-6(2)3-10(18)17-12(19)8-4-7(14)5-9(15)11(8)16-13(17)20/h4-6H,3H2,1-2H3,(H,16,20)