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

Systemtic Name: N-(5-chloranyl-2-piperidin-1-yl-phenyl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide Openeye Name: N-[5-chloro-2-(1-piperidyl)phenyl]-2-(1-phenyltetrazol-5-yl)sulfanyl-acetamide CAS Name: N-[5-chloro-2-(1-piperidinyl)phenyl]-2-[(1-phenyl-5-tetrazolyl)thio]acetamide IUPAC Name: N-(5-chloro-2-piperidin-1-ylphenyl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide Traditional Name: N-(5-chloro-2-piperidino-phenyl)-2-[(1-phenyltetrazol-5-yl)thio]acetamide Formula: C20H21ClN6OS MolecularWeight: 428.93834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)CSC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)CSC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C20H21ClN6OS/c21-15-9-10-18(26-11-5-2-6-12-26)17(13-15)22-19(28)14-29-20-23-24-25-27(20)16-7-3-1-4-8-16/h1,3-4,7-10,13H,2,5-6,11-12,14H2,(H,22,28)