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

Systemtic Name: N-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide Openeye Name: N-(2-chloro-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-(1-cyclohexyltetrazol-5-yl)sulfanyl-acetamide CAS Name: N-[2-chloro-5-(1-pyrrolidinylsulfonyl)phenyl]-2-[(1-cyclohexyl-5-tetrazolyl)thio]acetamide IUPAC Name: N-(2-chloro-5-pyrrolidin-1-ylsulfonylphenyl)-2-(1-cyclohexyltetrazol-5-yl)sulfanylacetamide Traditional Name: N-(2-chloro-5-pyrrolidinosulfonyl-phenyl)-2-[(1-cyclohexyltetrazol-5-yl)thio]acetamide Formula: C19H25ClN6O3S2 MolecularWeight: 485.0232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=N2)SCC(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)Cl

Isomeric SMILES

C1CCC(CC1)N2C(=NN=N2)SCC(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)Cl

InChI

InChI=1S/C19H25ClN6O3S2/c20-16-9-8-15(31(28,29)25-10-4-5-11-25)12-17(16)21-18(27)13-30-19-22-23-24-26(19)14-6-2-1-3-7-14/h8-9,12,14H,1-7,10-11,13H2,(H,21,27)