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

Systemtic Name: 5-[4-(4-tert-butylphenyl)sulfonyl-3-methyl-piperazin-1-yl]-3-[(4-methylphenyl)methyl]-1,2,4-thiadiazole Openeye Name: 5-[4-(4-tert-butylphenyl)sulfonyl-3-methyl-piperazin-1-yl]-3-(p-tolylmethyl)-1,2,4-thiadiazole CAS Name: 5-[4-(4-tert-butylphenyl)sulfonyl-3-methyl-1-piperazinyl]-3-[(4-methylphenyl)methyl]-1,2,4-thiadiazole IUPAC Name: 5-[4-(4-tert-butylphenyl)sulfonyl-3-methylpiperazin-1-yl]-3-[(4-methylphenyl)methyl]-1,2,4-thiadiazole Traditional Name: 5-[4-(4-tert-butylphenyl)sulfonyl-3-methyl-piperazino]-3-(4-methylbenzyl)-1,2,4-thiadiazole Formula: C25H32N4O2S2 MolecularWeight: 484.67718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H32N4O2S2/c1-18-6-8-20(9-7-18)16-23-26-24(32-27-23)28-14-15-29(19(2)17-28)33(30,31)22-12-10-21(11-13-22)25(3,4)5/h6-13,19H,14-17H2,1-5H3