4-chloranyl-2,5-dimethyl-N-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)pyrazole-3-carboxamide

Systemtic Name: 4-chloranyl-2,5-dimethyl-N-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)pyrazole-3-carboxamide Openeye Name: 4-chloro-2,5-dimethyl-N-(4-oxo-2-thioxo-1H-quinazolin-3-yl)pyrazole-3-carboxamide CAS Name: 4-chloro-2,5-dimethyl-N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-3-pyrazolecarboxamide IUPAC Name: 4-chloro-2,5-dimethyl-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)-2,5-dimethyl-pyrazole-3-carboxamide Formula: C14H12ClN5O2S MolecularWeight: 349.79538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1Cl)C(=O)NN2C(=O)C3=CC=CC=C3NC2=S)C

Isomeric SMILES

CC1=NN(C(=C1Cl)C(=O)NN2C(=O)C3=CC=CC=C3NC2=S)C

InChI

InChI=1S/C14H12ClN5O2S/c1-7-10(15)11(19(2)17-7)12(21)18-20-13(22)8-5-3-4-6-9(8)16-14(20)23/h3-6H,1-2H3,(H,16,23)(H,18,21)