(2R)-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-piperidin-1-yl-propan-1-one

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCC1)SC2=NN=C(N2C)C3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)N1CCCCC1)SC2=NN=C(N2C)C3=CC=CC=C3

InChI

InChI=1S/C17H22N4OS/c1-13(16(22)21-11-7-4-8-12-21)23-17-19-18-15(20(17)2)14-9-5-3-6-10-14/h3,5-6,9-10,13H,4,7-8,11-12H2,1-2H3/t13-/m1/s1