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

Systemtic Name: 4-(4-chlorophenyl)sulfanyl-6-(4-methylphenyl)sulfanyl-5-nitro-pyrimidine Openeye Name: 4-(4-chlorophenyl)sulfanyl-5-nitro-6-(p-tolylsulfanyl)pyrimidine CAS Name: 4-[(4-chlorophenyl)thio]-6-[(4-methylphenyl)thio]-5-nitropyrimidine IUPAC Name: 4-(4-chlorophenyl)sulfanyl-6-(4-methylphenyl)sulfanyl-5-nitropyrimidine Traditional Name: 4-[(4-chlorophenyl)thio]-5-nitro-6-(p-tolylthio)pyrimidine Formula: C17H12ClN3O2S2 MolecularWeight: 389.87908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C(=NC=N2)SC3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C(=NC=N2)SC3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H12ClN3O2S2/c1-11-2-6-13(7-3-11)24-16-15(21(22)23)17(20-10-19-16)25-14-8-4-12(18)5-9-14/h2-10H,1H3