3-[(4-methylphenyl)methyl]-5-(3-methyl-4-quinolin-8-ylsulfonyl-piperazin-1-yl)-1,2,4-thiadiazole

Systemtic Name: 3-[(4-methylphenyl)methyl]-5-(3-methyl-4-quinolin-8-ylsulfonyl-piperazin-1-yl)-1,2,4-thiadiazole Openeye Name: 5-[3-methyl-4-(8-quinolylsulfonyl)piperazin-1-yl]-3-(p-tolylmethyl)-1,2,4-thiadiazole CAS Name: 3-[(4-methylphenyl)methyl]-5-[3-methyl-4-(8-quinolinylsulfonyl)-1-piperazinyl]-1,2,4-thiadiazole IUPAC Name: 3-[(4-methylphenyl)methyl]-5-(3-methyl-4-quinolin-8-ylsulfonylpiperazin-1-yl)-1,2,4-thiadiazole Traditional Name: 3-(4-methylbenzyl)-5-[3-methyl-4-(8-quinolylsulfonyl)piperazino]-1,2,4-thiadiazole Formula: C24H25N5O2S2 MolecularWeight: 479.6176

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1S(=O)(=O)C2=CC=CC3=C2N=CC=C3)C4=NC(=NS4)CC5=CC=C(C=C5)C

Isomeric SMILES

CC1CN(CCN1S(=O)(=O)C2=CC=CC3=C2N=CC=C3)C4=NC(=NS4)CC5=CC=C(C=C5)C

InChI

InChI=1S/C24H25N5O2S2/c1-17-8-10-19(11-9-17)15-22-26-24(32-27-22)28-13-14-29(18(2)16-28)33(30,31)21-7-3-5-20-6-4-12-25-23(20)21/h3-12,18H,13-16H2,1-2H3