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

Systemtic Name: N-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide Openeye Name: N-(2-chloro-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-(1-cyclopropyltetrazol-5-yl)sulfanyl-acetamide CAS Name: N-[2-chloro-5-(1-pyrrolidinylsulfonyl)phenyl]-2-[(1-cyclopropyl-5-tetrazolyl)thio]acetamide IUPAC Name: N-(2-chloro-5-pyrrolidin-1-ylsulfonylphenyl)-2-(1-cyclopropyltetrazol-5-yl)sulfanylacetamide Traditional Name: N-(2-chloro-5-pyrrolidinosulfonyl-phenyl)-2-[(1-cyclopropyltetrazol-5-yl)thio]acetamide Formula: C16H19ClN6O3S2 MolecularWeight: 442.94346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)CSC3=NN=NN3C4CC4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)CSC3=NN=NN3C4CC4

InChI

InChI=1S/C16H19ClN6O3S2/c17-13-6-5-12(28(25,26)22-7-1-2-8-22)9-14(13)18-15(24)10-27-16-19-20-21-23(16)11-3-4-11/h5-6,9,11H,1-4,7-8,10H2,(H,18,24)