4-chloranyl-N'-[2-[6-chloranyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]benzohydrazide

Systemtic Name: 4-chloranyl-N'-[2-[6-chloranyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]benzohydrazide Openeye Name: 4-chloro-N'-[2-(6-chloro-3-isobutyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]benzohydrazide CAS Name: 4-chloro-N'-[2-[[6-chloro-3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]benzohydrazide IUPAC Name: 4-chloro-N'-[2-[6-chloro-3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]benzohydrazide Traditional Name: 4-chloro-N'-[2-[(6-chloro-3-isobutyl-4-keto-quinazolin-2-yl)thio]acetyl]benzohydrazide Formula: C21H20Cl2N4O3S MolecularWeight: 479.3795

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCC(=O)NNC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCC(=O)NNC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H20Cl2N4O3S/c1-12(2)10-27-20(30)16-9-15(23)7-8-17(16)24-21(27)31-11-18(28)25-26-19(29)13-3-5-14(22)6-4-13/h3-9,12H,10-11H2,1-2H3,(H,25,28)(H,26,29)