N-(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)-2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide

Systemtic Name: N-(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)-2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide Openeye Name: N-[2-chloro-5-(1-piperidylsulfonyl)phenyl]-2-(1-cyclopropyltetrazol-5-yl)sulfanyl-acetamide CAS Name: N-[2-chloro-5-(1-piperidinylsulfonyl)phenyl]-2-[(1-cyclopropyl-5-tetrazolyl)thio]acetamide IUPAC Name: N-(2-chloro-5-piperidin-1-ylsulfonylphenyl)-2-(1-cyclopropyltetrazol-5-yl)sulfanylacetamide Traditional Name: N-(2-chloro-5-piperidinosulfonyl-phenyl)-2-[(1-cyclopropyltetrazol-5-yl)thio]acetamide Formula: C17H21ClN6O3S2 MolecularWeight: 456.97004

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)CSC3=NN=NN3C4CC4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)CSC3=NN=NN3C4CC4

InChI

InChI=1S/C17H21ClN6O3S2/c18-14-7-6-13(29(26,27)23-8-2-1-3-9-23)10-15(14)19-16(25)11-28-17-20-21-22-24(17)12-4-5-12/h6-7,10,12H,1-5,8-9,11H2,(H,19,25)