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

Systemtic Name: N-(5-chloranyl-2-piperidin-1-yl-phenyl)-2-[[1-(4-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanamide Openeye Name: N-[5-chloro-2-(1-piperidyl)phenyl]-2-[1-(p-tolyl)tetrazol-5-yl]sulfanyl-acetamide CAS Name: N-[5-chloro-2-(1-piperidinyl)phenyl]-2-[[1-(4-methylphenyl)-5-tetrazolyl]thio]acetamide IUPAC Name: N-(5-chloro-2-piperidin-1-ylphenyl)-2-[1-(4-methylphenyl)tetrazol-5-yl]sulfanylacetamide Traditional Name: N-(5-chloro-2-piperidino-phenyl)-2-[[1-(p-tolyl)tetrazol-5-yl]thio]acetamide Formula: C21H23ClN6OS MolecularWeight: 442.96492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)NC3=C(C=CC(=C3)Cl)N4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)NC3=C(C=CC(=C3)Cl)N4CCCCC4

InChI

InChI=1S/C21H23ClN6OS/c1-15-5-8-17(9-6-15)28-21(24-25-26-28)30-14-20(29)23-18-13-16(22)7-10-19(18)27-11-3-2-4-12-27/h5-10,13H,2-4,11-12,14H2,1H3,(H,23,29)