4-(4-methylphenoxy)-6-(4-methylphenyl)sulfanyl-5-nitro-pyrimidine

Systemtic Name: 4-(4-methylphenoxy)-6-(4-methylphenyl)sulfanyl-5-nitro-pyrimidine Openeye Name: 4-(4-methylphenoxy)-5-nitro-6-(p-tolylsulfanyl)pyrimidine CAS Name: 4-(4-methylphenoxy)-6-[(4-methylphenyl)thio]-5-nitropyrimidine IUPAC Name: 4-(4-methylphenoxy)-6-(4-methylphenyl)sulfanyl-5-nitropyrimidine Traditional Name: 4-(4-methylphenoxy)-5-nitro-6-(p-tolylthio)pyrimidine Formula: C18H15N3O3S MolecularWeight: 353.395

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=C(C(=NC=N2)SC3=CC=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)OC2=C(C(=NC=N2)SC3=CC=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O3S/c1-12-3-7-14(8-4-12)24-17-16(21(22)23)18(20-11-19-17)25-15-9-5-13(2)6-10-15/h3-11H,1-2H3