3-(4-nitrophenyl)-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-(4-nitrophenyl)-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-(4-nitrophenyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 3-(4-nitrophenyl)-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-(4-nitrophenyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-(4-nitrophenyl)-2-thioxo-1H-quinazolin-4-one Formula: C14H9N3O3S MolecularWeight: 299.30456

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H9N3O3S/c18-13-11-3-1-2-4-12(11)15-14(21)16(13)9-5-7-10(8-6-9)17(19)20/h1-8H,(H,15,21)