2-[1-(4-chlorophenyl)sulfonyl-3,5-dimethyl-pyrazol-4-yl]sulfanylpyrimidine

Systemtic Name: 2-[1-(4-chlorophenyl)sulfonyl-3,5-dimethyl-pyrazol-4-yl]sulfanylpyrimidine Openeye Name: 2-[1-(4-chlorophenyl)sulfonyl-3,5-dimethyl-pyrazol-4-yl]sulfanylpyrimidine CAS Name: 2-[[1-(4-chlorophenyl)sulfonyl-3,5-dimethyl-4-pyrazolyl]thio]pyrimidine IUPAC Name: 2-[1-(4-chlorophenyl)sulfonyl-3,5-dimethylpyrazol-4-yl]sulfanylpyrimidine Traditional Name: 2-[[1-(4-chlorophenyl)sulfonyl-3,5-dimethyl-pyrazol-4-yl]thio]pyrimidine Formula: C15H13ClN4O2S2 MolecularWeight: 380.87232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1S(=O)(=O)C2=CC=C(C=C2)Cl)C)SC3=NC=CC=N3

Isomeric SMILES

CC1=C(C(=NN1S(=O)(=O)C2=CC=C(C=C2)Cl)C)SC3=NC=CC=N3

InChI

InChI=1S/C15H13ClN4O2S2/c1-10-14(23-15-17-8-3-9-18-15)11(2)20(19-10)24(21,22)13-6-4-12(16)5-7-13/h3-9H,1-2H3