5-(4-ethylsulfonyl-1,4-diazepan-1-yl)-3-(phenylmethyl)-1,2,4-thiadiazole

Systemtic Name: 5-(4-ethylsulfonyl-1,4-diazepan-1-yl)-3-(phenylmethyl)-1,2,4-thiadiazole Openeye Name: 3-benzyl-5-(4-ethylsulfonyl-1,4-diazepan-1-yl)-1,2,4-thiadiazole CAS Name: 5-(4-ethylsulfonyl-1,4-diazepan-1-yl)-3-(phenylmethyl)-1,2,4-thiadiazole IUPAC Name: 3-benzyl-5-(4-ethylsulfonyl-1,4-diazepan-1-yl)-1,2,4-thiadiazole Traditional Name: 3-benzyl-5-(4-esyl-1,4-diazepan-1-yl)-1,2,4-thiadiazole Formula: C16H22N4O2S2 MolecularWeight: 366.50148

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N4O2S2/c1-2-24(21,22)20-10-6-9-19(11-12-20)16-17-15(18-23-16)13-14-7-4-3-5-8-14/h3-5,7-8H,2,6,9-13H2,1H3