6-[(E)-2-[4-(4-methylphenyl)sulfanylphenyl]ethenyl]-5-nitro-1H-pyrimidine-2,4-dione

Systemtic Name: 6-[(E)-2-[4-(4-methylphenyl)sulfanylphenyl]ethenyl]-5-nitro-1H-pyrimidine-2,4-dione Openeye Name: 5-nitro-6-[(E)-2-[4-(p-tolylsulfanyl)phenyl]vinyl]-1H-pyrimidine-2,4-dione CAS Name: 6-[(E)-2-[4-[(4-methylphenyl)thio]phenyl]ethenyl]-5-nitro-1H-pyrimidine-2,4-dione IUPAC Name: 6-[(E)-2-[4-(4-methylphenyl)sulfanylphenyl]ethenyl]-5-nitro-1H-pyrimidine-2,4-dione Traditional Name: 5-nitro-6-[(E)-2-[4-(p-tolylthio)phenyl]vinyl]uracil Formula: C19H15N3O4S MolecularWeight: 381.4051

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=CC=C(C=C2)C=CC3=C(C(=O)NC(=O)N3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SC2=CC=C(C=C2)/C=C/C3=C(C(=O)NC(=O)N3)[N+](=O)[O-]

InChI

InChI=1S/C19H15N3O4S/c1-12-2-7-14(8-3-12)27-15-9-4-13(5-10-15)6-11-16-17(22(25)26)18(23)21-19(24)20-16/h2-11H,1H3,(H2,20,21,23,24)/b11-6+