4-chloranyl-2-methyl-N-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)pyrazole-3-carboxamide

Systemtic Name: 4-chloranyl-2-methyl-N-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)pyrazole-3-carboxamide Openeye Name: 4-chloro-2-methyl-N-(4-oxo-2-thioxo-1H-quinazolin-3-yl)pyrazole-3-carboxamide CAS Name: 4-chloro-2-methyl-N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-3-pyrazolecarboxamide IUPAC Name: 4-chloro-2-methyl-N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)pyrazole-3-carboxamide Traditional Name: 4-chloro-N-(4-keto-2-thioxo-1H-quinazolin-3-yl)-2-methyl-pyrazole-3-carboxamide Formula: C13H10ClN5O2S MolecularWeight: 335.7688

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)Cl)C(=O)NN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

CN1C(=C(C=N1)Cl)C(=O)NN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C13H10ClN5O2S/c1-18-10(8(14)6-15-18)11(20)17-19-12(21)7-4-2-3-5-9(7)16-13(19)22/h2-6H,1H3,(H,16,22)(H,17,20)