1-[[5-[(1S)-2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl]sulfanyl-4-pyridin-2-yl-1,2,4-triazol-3-yl]methyl]pyrrolidin-2-one

Systemtic Name: 1-[[5-[(1S)-2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl]sulfanyl-4-pyridin-2-yl-1,2,4-triazol-3-yl]methyl]pyrrolidin-2-one Openeye Name: 1-[[5-[(1S)-2-oxo-1-phenyl-2-(1-piperidyl)ethyl]sulfanyl-4-(2-pyridyl)-1,2,4-triazol-3-yl]methyl]pyrrolidin-2-one CAS Name: 1-[[5-[[(1S)-2-oxo-1-phenyl-2-(1-piperidinyl)ethyl]thio]-4-(2-pyridinyl)-1,2,4-triazol-3-yl]methyl]-2-pyrrolidinone IUPAC Name: 1-[[5-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]sulfanyl-4-pyridin-2-yl-1,2,4-triazol-3-yl]methyl]pyrrolidin-2-one Traditional Name: 1-[[5-[[(1S)-2-keto-1-phenyl-2-piperidino-ethyl]thio]-4-(2-pyridyl)-1,2,4-triazol-3-yl]methyl]-2-pyrrolidone Formula: C25H28N6O2S MolecularWeight: 476.59382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(C2=CC=CC=C2)SC3=NN=C(N3C4=CC=CC=N4)CN5CCCC5=O

Isomeric SMILES

C1CCN(CC1)C(=O)[C@H](C2=CC=CC=C2)SC3=NN=C(N3C4=CC=CC=N4)CN5CCCC5=O

InChI

InChI=1S/C25H28N6O2S/c32-22-13-9-17-30(22)18-21-27-28-25(31(21)20-12-5-6-14-26-20)34-23(19-10-3-1-4-11-19)24(33)29-15-7-2-8-16-29/h1,3-6,10-12,14,23H,2,7-9,13,15-18H2/t23-/m0/s1