2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanone CAS Name: 2-[(4-methyl-1,2,4-triazol-3-yl)thio]-1-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-[(4-methyl-1,2,4-triazol-3-yl)thio]-1-(4-p-cumenylsulfonylpiperazino)ethanone Formula: C18H25N5O3S2 MolecularWeight: 423.5528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CSC3=NN=CN3C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CSC3=NN=CN3C

InChI

InChI=1S/C18H25N5O3S2/c1-14(2)15-4-6-16(7-5-15)28(25,26)23-10-8-22(9-11-23)17(24)12-27-18-20-19-13-21(18)3/h4-7,13-14H,8-12H2,1-3H3