5-(4-butylsulfonyl-1,4-diazepan-1-yl)-3-[(4-methylphenyl)methyl]-1,2,4-thiadiazole

Systemtic Name: 5-(4-butylsulfonyl-1,4-diazepan-1-yl)-3-[(4-methylphenyl)methyl]-1,2,4-thiadiazole Openeye Name: 5-(4-butylsulfonyl-1,4-diazepan-1-yl)-3-(p-tolylmethyl)-1,2,4-thiadiazole CAS Name: 5-(4-butylsulfonyl-1,4-diazepan-1-yl)-3-[(4-methylphenyl)methyl]-1,2,4-thiadiazole IUPAC Name: 5-(4-butylsulfonyl-1,4-diazepan-1-yl)-3-[(4-methylphenyl)methyl]-1,2,4-thiadiazole Traditional Name: 5-(4-butylsulfonyl-1,4-diazepan-1-yl)-3-(4-methylbenzyl)-1,2,4-thiadiazole Formula: C19H28N4O2S2 MolecularWeight: 408.58122

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N1CCCN(CC1)C2=NC(=NS2)CC3=CC=C(C=C3)C

Isomeric SMILES

CCCCS(=O)(=O)N1CCCN(CC1)C2=NC(=NS2)CC3=CC=C(C=C3)C

InChI

InChI=1S/C19H28N4O2S2/c1-3-4-14-27(24,25)23-11-5-10-22(12-13-23)19-20-18(21-26-19)15-17-8-6-16(2)7-9-17/h6-9H,3-5,10-15H2,1-2H3