6-chloranyl-3-[(2-phenoxypyridin-3-yl)carbonylamino]-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 6-chloranyl-3-[(2-phenoxypyridin-3-yl)carbonylamino]-2-sulfanylidene-quinazolin-4-olate Openeye Name: 6-chloro-3-[(2-phenoxypyridine-3-carbonyl)amino]-2-thioxo-quinazolin-4-olate CAS Name: 6-chloro-3-[[oxo-(2-phenoxy-3-pyridinyl)methyl]amino]-2-sulfanylidene-4-quinazolinolate IUPAC Name: 6-chloro-3-[(2-phenoxypyridine-3-carbonyl)amino]-2-sulfanylidenequinazolin-4-olate Traditional Name: 6-chloro-3-[(2-phenoxynicotinoyl)amino]-2-thioxo-quinazolin-4-olate Formula: C20H12ClN4O3S- MolecularWeight: 423.85228

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C=CC=N2)C(=O)NN3C(=C4C=C(C=CC4=NC3=S)Cl)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C=CC=N2)C(=O)NN3C(=C4C=C(C=CC4=NC3=S)Cl)[O-]

InChI

InChI=1S/C20H13ClN4O3S/c21-12-8-9-16-15(11-12)19(27)25(20(29)23-16)24-17(26)14-7-4-10-22-18(14)28-13-5-2-1-3-6-13/h1-11,27H,(H,24,26)/p-1