(2R)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-1-piperidin-1-yl-ethanone

Systemtic Name: (2R)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-1-piperidin-1-yl-ethanone Openeye Name: (2R)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-1-(1-piperidyl)ethanone CAS Name: (2R)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]-2-phenyl-1-(1-piperidinyl)ethanone IUPAC Name: (2R)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-1-piperidin-1-ylethanone Traditional Name: (2R)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]-2-phenyl-1-piperidino-ethanone Formula: C17H22N4OS MolecularWeight: 330.44778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C)SC(C2=CC=CC=C2)C(=O)N3CCCCC3

Isomeric SMILES

CC1=NN=C(N1C)S[C@H](C2=CC=CC=C2)C(=O)N3CCCCC3

InChI

InChI=1S/C17H22N4OS/c1-13-18-19-17(20(13)2)23-15(14-9-5-3-6-10-14)16(22)21-11-7-4-8-12-21/h3,5-6,9-10,15H,4,7-8,11-12H2,1-2H3/t15-/m1/s1