3-[(4-methylphenyl)methyl]-5-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-1,2,4-thiadiazole

Systemtic Name: 3-[(4-methylphenyl)methyl]-5-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-1,2,4-thiadiazole Openeye Name: 5-(4-benzylsulfonylpiperazin-1-yl)-3-(p-tolylmethyl)-1,2,4-thiadiazole CAS Name: 3-[(4-methylphenyl)methyl]-5-[4-(phenylmethyl)sulfonyl-1-piperazinyl]-1,2,4-thiadiazole IUPAC Name: 5-(4-benzylsulfonylpiperazin-1-yl)-3-[(4-methylphenyl)methyl]-1,2,4-thiadiazole Traditional Name: 5-(4-benzylsulfonylpiperazino)-3-(4-methylbenzyl)-1,2,4-thiadiazole Formula: C21H24N4O2S2 MolecularWeight: 428.57086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=NSC(=N2)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CC2=NSC(=N2)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C21H24N4O2S2/c1-17-7-9-18(10-8-17)15-20-22-21(28-23-20)24-11-13-25(14-12-24)29(26,27)16-19-5-3-2-4-6-19/h2-10H,11-16H2,1H3