N-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)-2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)-2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[4-chloro-3-(1-piperidylsulfonyl)phenyl]-2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[4-chloro-3-(1-piperidinylsulfonyl)phenyl]-2-[(4-ethyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(4-chloro-3-piperidin-1-ylsulfonylphenyl)-2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(4-chloro-3-piperidinosulfonyl-phenyl)-2-[(4-ethyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C17H22ClN5O3S2 MolecularWeight: 443.97128

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NN=C1SCC(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCN1C=NN=C1SCC(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C17H22ClN5O3S2/c1-2-22-12-19-21-17(22)27-11-16(24)20-13-6-7-14(18)15(10-13)28(25,26)23-8-4-3-5-9-23/h6-7,10,12H,2-5,8-9,11H2,1H3,(H,20,24)