3-methyl-6-nitro-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-methyl-6-nitro-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-methyl-6-nitro-2-thioxo-1H-quinazolin-4-one CAS Name: 3-methyl-6-nitro-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-methyl-6-nitro-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-methyl-6-nitro-2-thioxo-1H-quinazolin-4-one Formula: C9H7N3O3S MolecularWeight: 237.23518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC1=S

Isomeric SMILES

CN1C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC1=S

InChI

InChI=1S/C9H7N3O3S/c1-11-8(13)6-4-5(12(14)15)2-3-7(6)10-9(11)16/h2-4H,1H3,(H,10,16)