4-(4-chloranyl-3-methyl-phenoxy)-6-(4-methylphenyl)sulfanyl-5-nitro-pyrimidine

Systemtic Name: 4-(4-chloranyl-3-methyl-phenoxy)-6-(4-methylphenyl)sulfanyl-5-nitro-pyrimidine Openeye Name: 4-(4-chloro-3-methyl-phenoxy)-5-nitro-6-(p-tolylsulfanyl)pyrimidine CAS Name: 4-(4-chloro-3-methylphenoxy)-6-[(4-methylphenyl)thio]-5-nitropyrimidine IUPAC Name: 4-(4-chloro-3-methylphenoxy)-6-(4-methylphenyl)sulfanyl-5-nitropyrimidine Traditional Name: 4-(4-chloro-3-methyl-phenoxy)-5-nitro-6-(p-tolylthio)pyrimidine Formula: C18H14ClN3O3S MolecularWeight: 387.84006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14ClN3O3S/c1-11-3-6-14(7-4-11)26-18-16(22(23)24)17(20-10-21-18)25-13-5-8-15(19)12(2)9-13/h3-10H,1-2H3