1-methyl-4-(2-methylphenyl)-6-nitro-thieno[2,3-d]pyrimidin-2-one

Systemtic Name: 1-methyl-4-(2-methylphenyl)-6-nitro-thieno[2,3-d]pyrimidin-2-one Openeye Name: 1-methyl-6-nitro-4-(o-tolyl)thieno[2,3-d]pyrimidin-2-one CAS Name: 1-methyl-4-(2-methylphenyl)-6-nitro-2-thieno[2,3-d]pyrimidinone IUPAC Name: 1-methyl-4-(2-methylphenyl)-6-nitrothieno[2,3-d]pyrimidin-2-one Traditional Name: 1-methyl-6-nitro-4-(o-tolyl)thieno[2,3-d]pyrimidin-2-one Formula: C14H11N3O3S MolecularWeight: 301.32044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC(=O)N(C3=C2C=C(S3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=CC=C1C2=NC(=O)N(C3=C2C=C(S3)[N+](=O)[O-])C

InChI

InChI=1S/C14H11N3O3S/c1-8-5-3-4-6-9(8)12-10-7-11(17(19)20)21-13(10)16(2)14(18)15-12/h3-7H,1-2H3