4-oxidanylidene-3-phenyl-N'-pyrazin-2-ylcarbonyl-2-sulfanylidene-1H-quinazoline-7-carbohydrazide

Systemtic Name: 4-oxidanylidene-3-phenyl-N'-pyrazin-2-ylcarbonyl-2-sulfanylidene-1H-quinazoline-7-carbohydrazide Openeye Name: 4-oxo-3-phenyl-N'-(pyrazine-2-carbonyl)-2-thioxo-1H-quinazoline-7-carbohydrazide CAS Name: 4-oxo-N'-[oxo(2-pyrazinyl)methyl]-3-phenyl-2-sulfanylidene-1H-quinazoline-7-carbohydrazide IUPAC Name: 4-oxo-3-phenyl-N'-(pyrazine-2-carbonyl)-2-sulfanylidene-1H-quinazoline-7-carbohydrazide Traditional Name: 4-keto-3-phenyl-N'-pyrazinoyl-2-thioxo-1H-quinazoline-7-carbohydrazide Formula: C20H14N6O3S MolecularWeight: 418.42856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)NNC(=O)C4=NC=CN=C4)NC2=S

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)NNC(=O)C4=NC=CN=C4)NC2=S

InChI

InChI=1S/C20H14N6O3S/c27-17(24-25-18(28)16-11-21-8-9-22-16)12-6-7-14-15(10-12)23-20(30)26(19(14)29)13-4-2-1-3-5-13/h1-11H,(H,23,30)(H,24,27)(H,25,28)