4-(3,5-dimethylphenoxy)-6-(4-methylphenyl)sulfanyl-5-nitro-pyrimidine

Systemtic Name: 4-(3,5-dimethylphenoxy)-6-(4-methylphenyl)sulfanyl-5-nitro-pyrimidine Openeye Name: 4-(3,5-dimethylphenoxy)-5-nitro-6-(p-tolylsulfanyl)pyrimidine CAS Name: 4-(3,5-dimethylphenoxy)-6-[(4-methylphenyl)thio]-5-nitropyrimidine IUPAC Name: 4-(3,5-dimethylphenoxy)-6-(4-methylphenyl)sulfanyl-5-nitropyrimidine Traditional Name: 4-(3,5-dimethylphenoxy)-5-nitro-6-(p-tolylthio)pyrimidine Formula: C19H17N3O3S MolecularWeight: 367.42158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])OC3=CC(=CC(=C3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])OC3=CC(=CC(=C3)C)C

InChI

InChI=1S/C19H17N3O3S/c1-12-4-6-16(7-5-12)26-19-17(22(23)24)18(20-11-21-19)25-15-9-13(2)8-14(3)10-15/h4-11H,1-3H3