2-ethyl-4-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)pyrazole-3-carboxamide

Systemtic Name: 2-ethyl-4-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)pyrazole-3-carboxamide Openeye Name: 2-ethyl-4-(4-oxo-2-thioxo-1H-quinazolin-3-yl)pyrazole-3-carboxamide CAS Name: 2-ethyl-4-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-3-pyrazolecarboxamide IUPAC Name: 2-ethyl-4-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)pyrazole-3-carboxamide Traditional Name: 2-ethyl-4-(4-keto-2-thioxo-1H-quinazolin-3-yl)pyrazole-3-carboxamide Formula: C14H13N5O2S MolecularWeight: 315.35032

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)N2C(=O)C3=CC=CC=C3NC2=S)C(=O)N

Isomeric SMILES

CCN1C(=C(C=N1)N2C(=O)C3=CC=CC=C3NC2=S)C(=O)N

InChI

InChI=1S/C14H13N5O2S/c1-2-18-11(12(15)20)10(7-16-18)19-13(21)8-5-3-4-6-9(8)17-14(19)22/h3-7H,2H2,1H3,(H2,15,20)(H,17,22)