3-ethyl-N'-(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carbohydrazide

Systemtic Name: 3-ethyl-N'-(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carbohydrazide Openeye Name: 3-ethyl-N'-(3-methyl-4-oxo-phthalazine-1-carbonyl)-4-oxo-2-thioxo-1H-quinazoline-7-carbohydrazide CAS Name: 3-ethyl-N'-[(3-methyl-4-oxo-1-phthalazinyl)-oxomethyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carbohydrazide IUPAC Name: 3-ethyl-N'-(3-methyl-4-oxophthalazine-1-carbonyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carbohydrazide Traditional Name: 3-ethyl-4-keto-N'-(4-keto-3-methyl-phthalazine-1-carbonyl)-2-thioxo-1H-quinazoline-7-carbohydrazide Formula: C21H18N6O4S MolecularWeight: 450.47042

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NNC(=O)C3=NN(C(=O)C4=CC=CC=C43)C)NC1=S

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NNC(=O)C3=NN(C(=O)C4=CC=CC=C43)C)NC1=S

InChI

InChI=1S/C21H18N6O4S/c1-3-27-20(31)14-9-8-11(10-15(14)22-21(27)32)17(28)23-24-18(29)16-12-6-4-5-7-13(12)19(30)26(2)25-16/h4-10H,3H2,1-2H3,(H,22,32)(H,23,28)(H,24,29)