3-nitro-N'-[2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoyl]benzohydrazide

Systemtic Name: 3-nitro-N'-[2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoyl]benzohydrazide Openeye Name: N'-[2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]-3-nitro-benzohydrazide CAS Name: 3-nitro-N'-[1-oxo-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]ethyl]benzohydrazide IUPAC Name: 3-nitro-N'-[2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetyl]benzohydrazide Traditional Name: N'-[2-[(3-allyl-4-keto-quinazolin-2-yl)thio]acetyl]-3-nitro-benzohydrazide Formula: C20H17N5O5S MolecularWeight: 439.44448

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H17N5O5S/c1-2-10-24-19(28)15-8-3-4-9-16(15)21-20(24)31-12-17(26)22-23-18(27)13-6-5-7-14(11-13)25(29)30/h2-9,11H,1,10,12H2,(H,22,26)(H,23,27)