3-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-methyl-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 3-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-methyl-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 3-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-methyl-1-[4-(p-tolylsulfonyl)piperazin-1-yl]propan-1-one CAS Name: 3-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-methyl-1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 3-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-methyl-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 3-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-methyl-1-(4-tosylpiperazino)propan-1-one Formula: C19H27N5O3S MolecularWeight: 405.51438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C(C)CN3C(=NC(=N3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C(C)CN3C(=NC(=N3)C)C

InChI

InChI=1S/C19H27N5O3S/c1-14-5-7-18(8-6-14)28(26,27)23-11-9-22(10-12-23)19(25)15(2)13-24-17(4)20-16(3)21-24/h5-8,15H,9-13H2,1-4H3