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

Systemtic Name: 3-(2-nitrophenyl)carbonyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-(2-nitrobenzoyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[(2-nitrophenyl)-oxomethyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-(2-nitrobenzoyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-(2-nitrobenzoyl)-2-thioxo-1H-quinazolin-4-one Formula: C15H9N3O4S MolecularWeight: 327.31466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H9N3O4S/c19-13-9-5-1-3-7-11(9)16-15(23)17(13)14(20)10-6-2-4-8-12(10)18(21)22/h1-8H,(H,16,23)