3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-sulfanylidene-quinazolin-4-olate Openeye Name: 3-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-thioxo-quinazolin-4-olate CAS Name: 3-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-sulfanylidene-4-quinazolinolate IUPAC Name: 3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-sulfanylidenequinazolin-4-olate Traditional Name: 3-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-2-thioxo-quinazolin-4-olate Formula: C19H15N4O2S- MolecularWeight: 363.413

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N3C(=C4C=CC=CC4=NC3=S)[O-]

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N3C(=C4C=CC=CC4=NC3=S)[O-]

InChI

InChI=1S/C19H16N4O2S/c1-12-16(18(25)23(21(12)2)13-8-4-3-5-9-13)22-17(24)14-10-6-7-11-15(14)20-19(22)26/h3-11,24H,1-2H3/p-1