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

Systemtic Name: 5-(4-ethylsulfonyl-1,4-diazepan-1-yl)-3-[(4-methylphenyl)methyl]-1,2,4-thiadiazole Openeye Name: 5-(4-ethylsulfonyl-1,4-diazepan-1-yl)-3-(p-tolylmethyl)-1,2,4-thiadiazole CAS Name: 5-(4-ethylsulfonyl-1,4-diazepan-1-yl)-3-[(4-methylphenyl)methyl]-1,2,4-thiadiazole IUPAC Name: 5-(4-ethylsulfonyl-1,4-diazepan-1-yl)-3-[(4-methylphenyl)methyl]-1,2,4-thiadiazole Traditional Name: 5-(4-esyl-1,4-diazepan-1-yl)-3-(4-methylbenzyl)-1,2,4-thiadiazole Formula: C17H24N4O2S2 MolecularWeight: 380.52806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N4O2S2/c1-3-25(22,23)21-10-4-9-20(11-12-21)17-18-16(19-24-17)13-15-7-5-14(2)6-8-15/h5-8H,3-4,9-13H2,1-2H3