4-[[1-[1-(2-thiophen-3-ylethanoyl)piperidin-4-yl]-1,2,3-triazol-4-yl]methyl]piperazin-2-one

Systemtic Name: 4-[[1-[1-(2-thiophen-3-ylethanoyl)piperidin-4-yl]-1,2,3-triazol-4-yl]methyl]piperazin-2-one Openeye Name: 4-[[1-[1-[2-(3-thienyl)acetyl]-4-piperidyl]triazol-4-yl]methyl]piperazin-2-one CAS Name: 4-[[1-[1-[1-oxo-2-(3-thiophenyl)ethyl]-4-piperidinyl]-4-triazolyl]methyl]-2-piperazinone IUPAC Name: 4-[[1-[1-(2-thiophen-3-ylacetyl)piperidin-4-yl]triazol-4-yl]methyl]piperazin-2-one Traditional Name: 4-[[1-[1-[2-(3-thienyl)acetyl]-4-piperidyl]triazol-4-yl]methyl]piperazin-2-one Formula: C18H24N6O2S MolecularWeight: 388.48716

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C=C(N=N2)CN3CCNC(=O)C3)C(=O)CC4=CSC=C4

Isomeric SMILES

C1CN(CCC1N2C=C(N=N2)CN3CCNC(=O)C3)C(=O)CC4=CSC=C4

InChI

InChI=1S/C18H24N6O2S/c25-17-12-22(7-4-19-17)10-15-11-24(21-20-15)16-1-5-23(6-2-16)18(26)9-14-3-8-27-13-14/h3,8,11,13,16H,1-2,4-7,9-10,12H2,(H,19,25)