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

Systemtic Name: 4-chloranyl-N'-[2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanylethanoyl]benzohydrazide Openeye Name: 4-chloro-N'-[2-[3-(3-hydroxypropyl)-4-oxo-quinazolin-2-yl]sulfanylacetyl]benzohydrazide CAS Name: 4-chloro-N'-[2-[[3-(3-hydroxypropyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]benzohydrazide IUPAC Name: 4-chloro-N'-[2-[3-(3-hydroxypropyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]benzohydrazide Traditional Name: 4-chloro-N'-[2-[[3-(3-hydroxypropyl)-4-keto-quinazolin-2-yl]thio]acetyl]benzohydrazide Formula: C20H19ClN4O4S MolecularWeight: 446.90726

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)NNC(=O)C3=CC=C(C=C3)Cl)CCCO

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)NNC(=O)C3=CC=C(C=C3)Cl)CCCO

InChI

InChI=1S/C20H19ClN4O4S/c21-14-8-6-13(7-9-14)18(28)24-23-17(27)12-30-20-22-16-5-2-1-4-15(16)19(29)25(20)10-3-11-26/h1-2,4-9,26H,3,10-12H2,(H,23,27)(H,24,28)