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

Systemtic Name: N-(3-chloranyl-2-piperidin-1-yl-phenyl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide Openeye Name: N-[3-chloro-2-(1-piperidyl)phenyl]-2-(1-phenyltetrazol-5-yl)sulfanyl-acetamide CAS Name: N-[3-chloro-2-(1-piperidinyl)phenyl]-2-[(1-phenyl-5-tetrazolyl)thio]acetamide IUPAC Name: N-(3-chloro-2-piperidin-1-ylphenyl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide Traditional Name: N-(3-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=CC=C2Cl)NC(=O)CSC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)CSC3=NN=NN3C4=CC=CC=C4

InChI

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