3-[(5-cyclopropyl-1H-pyrazol-3-yl)carbonylamino]-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 3-[(5-cyclopropyl-1H-pyrazol-3-yl)carbonylamino]-2-sulfanylidene-quinazolin-4-olate Openeye Name: 3-[(5-cyclopropyl-1H-pyrazole-3-carbonyl)amino]-2-thioxo-quinazolin-4-olate CAS Name: 3-[[(5-cyclopropyl-1H-pyrazol-3-yl)-oxomethyl]amino]-2-sulfanylidene-4-quinazolinolate IUPAC Name: 3-[(5-cyclopropyl-1H-pyrazole-3-carbonyl)amino]-2-sulfanylidenequinazolin-4-olate Traditional Name: 3-[(5-cyclopropyl-1H-pyrazole-3-carbonyl)amino]-2-thioxo-quinazolin-4-olate Formula: C15H12N5O2S- MolecularWeight: 326.35308

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(=NN2)C(=O)NN3C(=C4C=CC=CC4=NC3=S)[O-]

Isomeric SMILES

C1CC1C2=CC(=NN2)C(=O)NN3C(=C4C=CC=CC4=NC3=S)[O-]

InChI

InChI=1S/C15H13N5O2S/c21-13(12-7-11(17-18-12)8-5-6-8)19-20-14(22)9-3-1-2-4-10(9)16-15(20)23/h1-4,7-8,22H,5-6H2,(H,17,18)(H,19,21)/p-1