3-methyl-7-(3-methyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)-2,4-dihydro-1H-quinazoline-4-carboxylic acid

Systemtic Name: 3-methyl-7-(3-methyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)-2,4-dihydro-1H-quinazoline-4-carboxylic acid Openeye Name: 3-methyl-7-(3-methyl-5-thioxo-1H-1,2,4-triazol-4-yl)-2,4-dihydro-1H-quinazoline-4-carboxylic acid CAS Name: 3-methyl-7-(3-methyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)-2,4-dihydro-1H-quinazoline-4-carboxylic acid IUPAC Name: 3-methyl-7-(3-methyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)-2,4-dihydro-1H-quinazoline-4-carboxylic acid Traditional Name: 3-methyl-7-(3-methyl-5-thioxo-1H-1,2,4-triazol-4-yl)-2,4-dihydro-1H-quinazoline-4-carboxylic acid Formula: C13H15N5O2S MolecularWeight: 305.3555

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N1C2=CC3=C(C=C2)C(N(CN3)C)C(=O)O

Isomeric SMILES

CC1=NNC(=S)N1C2=CC3=C(C=C2)C(N(CN3)C)C(=O)O

InChI

InChI=1S/C13H15N5O2S/c1-7-15-16-13(21)18(7)8-3-4-9-10(5-8)14-6-17(2)11(9)12(19)20/h3-5,11,14H,6H2,1-2H3,(H,16,21)(H,19,20)