5-(4-butylsulfonylpiperazin-1-yl)-3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazole

Systemtic Name: 5-(4-butylsulfonylpiperazin-1-yl)-3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazole Openeye Name: 5-(4-butylsulfonylpiperazin-1-yl)-3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazole CAS Name: 5-(4-butylsulfonyl-1-piperazinyl)-3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazole IUPAC Name: 5-(4-butylsulfonylpiperazin-1-yl)-3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazole Traditional Name: 5-(4-butylsulfonylpiperazino)-3-(4-chlorobenzyl)-1,2,4-thiadiazole Formula: C17H23ClN4O2S2 MolecularWeight: 414.97312

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N1CCN(CC1)C2=NC(=NS2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCS(=O)(=O)N1CCN(CC1)C2=NC(=NS2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H23ClN4O2S2/c1-2-3-12-26(23,24)22-10-8-21(9-11-22)17-19-16(20-25-17)13-14-4-6-15(18)7-5-14/h4-7H,2-3,8-13H2,1H3