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

Systemtic Name: 5-[4-(4-bromophenyl)sulfonyl-3-methyl-piperazin-1-yl]-3-[(4-methylphenyl)methyl]-1,2,4-thiadiazole Openeye Name: 5-[4-(4-bromophenyl)sulfonyl-3-methyl-piperazin-1-yl]-3-(p-tolylmethyl)-1,2,4-thiadiazole CAS Name: 5-[4-(4-bromophenyl)sulfonyl-3-methyl-1-piperazinyl]-3-[(4-methylphenyl)methyl]-1,2,4-thiadiazole IUPAC Name: 5-[4-(4-bromophenyl)sulfonyl-3-methylpiperazin-1-yl]-3-[(4-methylphenyl)methyl]-1,2,4-thiadiazole Traditional Name: 5-(4-brosyl-3-methyl-piperazino)-3-(4-methylbenzyl)-1,2,4-thiadiazole Formula: C21H23BrN4O2S2 MolecularWeight: 507.46692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23BrN4O2S2/c1-15-3-5-17(6-4-15)13-20-23-21(29-24-20)25-11-12-26(16(2)14-25)30(27,28)19-9-7-18(22)8-10-19/h3-10,16H,11-14H2,1-2H3