1-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonyl-4-(2-methylsulfanylphenyl)piperazine

Systemtic Name: 1-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonyl-4-(2-methylsulfanylphenyl)piperazine Openeye Name: 1-(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonyl-4-(2-methylsulfanylphenyl)piperazine CAS Name: 1-[(5-chloro-1,3-dimethyl-4-pyrazolyl)sulfonyl]-4-[2-(methylthio)phenyl]piperazine IUPAC Name: 1-(5-chloro-1,3-dimethylpyrazol-4-yl)sulfonyl-4-(2-methylsulfanylphenyl)piperazine Traditional Name: 1-(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonyl-4-[2-(methylthio)phenyl]piperazine Formula: C16H21ClN4O2S2 MolecularWeight: 400.94654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3SC)Cl)C

Isomeric SMILES

CC1=NN(C(=C1S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3SC)Cl)C

InChI

InChI=1S/C16H21ClN4O2S2/c1-12-15(16(17)19(2)18-12)25(22,23)21-10-8-20(9-11-21)13-6-4-5-7-14(13)24-3/h4-7H,8-11H2,1-3H3