(2S)-1-(4-ethylpiperazin-1-yl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propan-1-one

Systemtic Name: (2S)-1-(4-ethylpiperazin-1-yl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Openeye Name: (2S)-1-(4-ethylpiperazin-1-yl)-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propan-1-one CAS Name: (2S)-1-(4-ethyl-1-piperazinyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]-1-propanone IUPAC Name: (2S)-1-(4-ethylpiperazin-1-yl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Traditional Name: (2S)-1-(4-ethylpiperazino)-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]propan-1-one Formula: C15H21N5OS2 MolecularWeight: 351.49014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C(C)SC2=NNC(=N2)C3=CC=CS3

Isomeric SMILES

CCN1CCN(CC1)C(=O)[C@H](C)SC2=NNC(=N2)C3=CC=CS3

InChI

InChI=1S/C15H21N5OS2/c1-3-19-6-8-20(9-7-19)14(21)11(2)23-15-16-13(17-18-15)12-5-4-10-22-12/h4-5,10-11H,3,6-9H2,1-2H3,(H,16,17,18)/t11-/m0/s1