1-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanone Openeye Name: 1-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanone CAS Name: 1-[4-(3,4-dichlorophenyl)sulfonyl-1-piperazinyl]-2-[(4,6-dimethyl-2-pyrimidinyl)thio]ethanone IUPAC Name: 1-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanone Traditional Name: 1-[4-(3,4-dichlorophenyl)sulfonylpiperazino]-2-[(4,6-dimethylpyrimidin-2-yl)thio]ethanone Formula: C18H20Cl2N4O3S2 MolecularWeight: 475.4124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)Cl)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)Cl)C

InChI

InChI=1S/C18H20Cl2N4O3S2/c1-12-9-13(2)22-18(21-12)28-11-17(25)23-5-7-24(8-6-23)29(26,27)14-3-4-15(19)16(20)10-14/h3-4,9-10H,5-8,11H2,1-2H3