N'-[2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoyl]thiophene-2-carbohydrazide

Systemtic Name: N'-[2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoyl]thiophene-2-carbohydrazide Openeye Name: N'-[2-(3-hexyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]thiophene-2-carbohydrazide CAS Name: N'-[2-[(3-hexyl-4-oxo-2-quinazolinyl)thio]-1-oxoethyl]-2-thiophenecarbohydrazide IUPAC Name: N'-[2-(3-hexyl-4-oxoquinazolin-2-yl)sulfanylacetyl]thiophene-2-carbohydrazide Traditional Name: N'-[2-[(3-hexyl-4-keto-quinazolin-2-yl)thio]acetyl]thiophene-2-carbohydrazide Formula: C21H24N4O3S2 MolecularWeight: 444.57026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NNC(=O)C3=CC=CS3

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NNC(=O)C3=CC=CS3

InChI

InChI=1S/C21H24N4O3S2/c1-2-3-4-7-12-25-20(28)15-9-5-6-10-16(15)22-21(25)30-14-18(26)23-24-19(27)17-11-8-13-29-17/h5-6,8-11,13H,2-4,7,12,14H2,1H3,(H,23,26)(H,24,27)