3-[[(2R)-2-(4-methylpyrazol-1-yl)propanoyl]amino]-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 3-[[(2R)-2-(4-methylpyrazol-1-yl)propanoyl]amino]-2-sulfanylidene-quinazolin-4-olate Openeye Name: 3-[[(2R)-2-(4-methylpyrazol-1-yl)propanoyl]amino]-2-thioxo-quinazolin-4-olate CAS Name: 3-[[(2R)-2-(4-methyl-1-pyrazolyl)-1-oxopropyl]amino]-2-sulfanylidene-4-quinazolinolate IUPAC Name: 3-[[(2R)-2-(4-methylpyrazol-1-yl)propanoyl]amino]-2-sulfanylidenequinazolin-4-olate Traditional Name: 3-[[(2R)-2-(4-methylpyrazol-1-yl)propanoyl]amino]-2-thioxo-quinazolin-4-olate Formula: C15H14N5O2S- MolecularWeight: 328.36896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(N=C1)C(C)C(=O)NN2C(=C3C=CC=CC3=NC2=S)[O-]

Isomeric SMILES

CC1=CN(N=C1)[C@H](C)C(=O)NN2C(=C3C=CC=CC3=NC2=S)[O-]

InChI

InChI=1S/C15H15N5O2S/c1-9-7-16-19(8-9)10(2)13(21)18-20-14(22)11-5-3-4-6-12(11)17-15(20)23/h3-8,10,22H,1-2H3,(H,18,21)/p-1/t10-/m1/s1