1-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-[4-(4-hydroxyphenyl)-1-piperazinyl]-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-[4-(4-hydroxyphenyl)piperazino]-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]ethanone Formula: C18H19N5O2S2 MolecularWeight: 401.50576

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)O)C(=O)CSC3=NNC(=N3)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)O)C(=O)CSC3=NNC(=N3)C4=CC=CS4

InChI

InChI=1S/C18H19N5O2S2/c24-14-5-3-13(4-6-14)22-7-9-23(10-8-22)16(25)12-27-18-19-17(20-21-18)15-2-1-11-26-15/h1-6,11,24H,7-10,12H2,(H,19,20,21)