1,2-dimethyl-6-nitro-8-(2-oxidanylethenyl)quinazoline-4-thione

Systemtic Name: 1,2-dimethyl-6-nitro-8-(2-oxidanylethenyl)quinazoline-4-thione Openeye Name: 8-(2-hydroxyvinyl)-1,2-dimethyl-6-nitro-quinazoline-4-thione CAS Name: 8-(2-hydroxyethenyl)-1,2-dimethyl-6-nitro-4-quinazolinethione IUPAC Name: 8-(2-hydroxyethenyl)-1,2-dimethyl-6-nitroquinazoline-4-thione Traditional Name: 8-(2-hydroxyvinyl)-1,2-dimethyl-6-nitro-quinazoline-4-thione Formula: C12H11N3O3S MolecularWeight: 277.29904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=S)C2=CC(=CC(=C2N1C)C=CO)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=S)C2=CC(=CC(=C2N1C)C=CO)[N+](=O)[O-]

InChI

InChI=1S/C12H11N3O3S/c1-7-13-12(19)10-6-9(15(17)18)5-8(3-4-16)11(10)14(7)2/h3-6,16H,1-2H3