3-chloranyl-6-fluoranyl-N'-[3-(8-methyl-4-oxidanylidene-quinazolin-3-yl)propanoyl]-1-benzothiophene-2-carbohydrazide

Systemtic Name: 3-chloranyl-6-fluoranyl-N'-[3-(8-methyl-4-oxidanylidene-quinazolin-3-yl)propanoyl]-1-benzothiophene-2-carbohydrazide Openeye Name: 3-chloro-6-fluoro-N'-[3-(8-methyl-4-oxo-quinazolin-3-yl)propanoyl]benzothiophene-2-carbohydrazide CAS Name: 3-chloro-6-fluoro-N'-[3-(8-methyl-4-oxo-3-quinazolinyl)-1-oxopropyl]-1-benzothiophene-2-carbohydrazide IUPAC Name: 3-chloro-6-fluoro-N'-[3-(8-methyl-4-oxoquinazolin-3-yl)propanoyl]-1-benzothiophene-2-carbohydrazide Traditional Name: 3-chloro-6-fluoro-N'-[3-(4-keto-8-methyl-quinazolin-3-yl)propanoyl]benzothiophene-2-carbohydrazide Formula: C21H16ClFN4O3S MolecularWeight: 458.893143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CCC(=O)NNC(=O)C3=C(C4=C(S3)C=C(C=C4)F)Cl

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CCC(=O)NNC(=O)C3=C(C4=C(S3)C=C(C=C4)F)Cl

InChI

InChI=1S/C21H16ClFN4O3S/c1-11-3-2-4-14-18(11)24-10-27(21(14)30)8-7-16(28)25-26-20(29)19-17(22)13-6-5-12(23)9-15(13)31-19/h2-6,9-10H,7-8H2,1H3,(H,25,28)(H,26,29)