3-nitro-4-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-benzamide

Systemtic Name: 3-nitro-4-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-benzamide Openeye Name: 4-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-3-nitro-benzamide CAS Name: 3-nitro-4-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]benzamide IUPAC Name: 3-nitro-4-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylbenzamide Traditional Name: 4-[(3-allyl-4-keto-quinazolin-2-yl)thio]-3-nitro-benzamide Formula: C18H14N4O4S MolecularWeight: 382.39316

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=CC=CC=C2N=C1SC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C=CCN1C(=O)C2=CC=CC=C2N=C1SC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C18H14N4O4S/c1-2-9-21-17(24)12-5-3-4-6-13(12)20-18(21)27-15-8-7-11(16(19)23)10-14(15)22(25)26/h2-8,10H,1,9H2,(H2,19,23)