2-(4-methyl-3-nitro-phenyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-(4-methyl-3-nitro-phenyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(4-methyl-3-nitro-phenyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-(4-methyl-3-nitrophenyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-(4-methyl-3-nitrophenyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(4-methyl-3-nitro-phenyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C13H9N3O3S MolecularWeight: 287.29386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=C(C=CS3)C(=O)N2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=C(C=CS3)C(=O)N2)[N+](=O)[O-]

InChI

InChI=1S/C13H9N3O3S/c1-7-2-3-8(6-10(7)16(18)19)11-14-12(17)9-4-5-20-13(9)15-11/h2-6H,1H3,(H,14,15,17)