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

Systemtic Name: 3-[[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]carbonylamino]-2-sulfanylidene-quinazolin-4-olate Openeye Name: 3-[[3-(4-methoxyphenyl)-1H-pyrazole-5-carbonyl]amino]-2-thioxo-quinazolin-4-olate CAS Name: 3-[[[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-oxomethyl]amino]-2-sulfanylidene-4-quinazolinolate IUPAC Name: 3-[[3-(4-methoxyphenyl)-1H-pyrazole-5-carbonyl]amino]-2-sulfanylidenequinazolin-4-olate Traditional Name: 3-[[3-(4-methoxyphenyl)-1H-pyrazole-5-carbonyl]amino]-2-thioxo-quinazolin-4-olate Formula: C19H14N5O3S- MolecularWeight: 392.41116

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NNC(=C2)C(=O)NN3C(=C4C=CC=CC4=NC3=S)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NNC(=C2)C(=O)NN3C(=C4C=CC=CC4=NC3=S)[O-]

InChI

InChI=1S/C19H15N5O3S/c1-27-12-8-6-11(7-9-12)15-10-16(22-21-15)17(25)23-24-18(26)13-4-2-3-5-14(13)20-19(24)28/h2-10,26H,1H3,(H,21,22)(H,23,25)/p-1