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

Systemtic Name: N-(3-chloranyl-2-piperidin-1-yl-phenyl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[3-chloro-2-(1-piperidyl)phenyl]-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[3-chloro-2-(1-piperidinyl)phenyl]-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(3-chloro-2-piperidin-1-ylphenyl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(3-chloro-2-piperidino-phenyl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C17H22ClN5OS MolecularWeight: 379.90748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C)SCC(=O)NC2=C(C(=CC=C2)Cl)N3CCCCC3

Isomeric SMILES

CC1=NN=C(N1C)SCC(=O)NC2=C(C(=CC=C2)Cl)N3CCCCC3

InChI

InChI=1S/C17H22ClN5OS/c1-12-20-21-17(22(12)2)25-11-15(24)19-14-8-6-7-13(18)16(14)23-9-4-3-5-10-23/h6-8H,3-5,9-11H2,1-2H3,(H,19,24)