4-chloranyl-N'-[3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanoyl]benzohydrazide

Systemtic Name: 4-chloranyl-N'-[3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanoyl]benzohydrazide Openeye Name: 4-chloro-N'-[3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanoyl]benzohydrazide CAS Name: 4-chloro-N'-[1-oxo-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propyl]benzohydrazide IUPAC Name: 4-chloro-N'-[3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanoyl]benzohydrazide Traditional Name: 4-chloro-N'-[3-(4-keto-2-thioxo-1H-quinazolin-3-yl)propanoyl]benzohydrazide Formula: C18H15ClN4O3S MolecularWeight: 402.8547

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CCC(=O)NNC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CCC(=O)NNC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H15ClN4O3S/c19-12-7-5-11(6-8-12)16(25)22-21-15(24)9-10-23-17(26)13-3-1-2-4-14(13)20-18(23)27/h1-8H,9-10H2,(H,20,27)(H,21,24)(H,22,25)