5-[3-methyl-4-(4-methylphenyl)sulfonyl-piperazin-1-yl]-3-[(4-methylphenyl)methyl]-1,2,4-thiadiazole

Systemtic Name: 5-[3-methyl-4-(4-methylphenyl)sulfonyl-piperazin-1-yl]-3-[(4-methylphenyl)methyl]-1,2,4-thiadiazole Openeye Name: 5-[3-methyl-4-(p-tolylsulfonyl)piperazin-1-yl]-3-(p-tolylmethyl)-1,2,4-thiadiazole CAS Name: 5-[3-methyl-4-(4-methylphenyl)sulfonyl-1-piperazinyl]-3-[(4-methylphenyl)methyl]-1,2,4-thiadiazole IUPAC Name: 5-[3-methyl-4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-[(4-methylphenyl)methyl]-1,2,4-thiadiazole Traditional Name: 3-(4-methylbenzyl)-5-(3-methyl-4-tosyl-piperazino)-1,2,4-thiadiazole Formula: C22H26N4O2S2 MolecularWeight: 442.59744

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1S(=O)(=O)C2=CC=C(C=C2)C)C3=NC(=NS3)CC4=CC=C(C=C4)C

Isomeric SMILES

CC1CN(CCN1S(=O)(=O)C2=CC=C(C=C2)C)C3=NC(=NS3)CC4=CC=C(C=C4)C

InChI

InChI=1S/C22H26N4O2S2/c1-16-4-8-19(9-5-16)14-21-23-22(29-24-21)25-12-13-26(18(3)15-25)30(27,28)20-10-6-17(2)7-11-20/h4-11,18H,12-15H2,1-3H3