1-(4-phenoxyphenyl)-2-[[4-(2-thiophen-2-ylethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone

Systemtic Name: 1-(4-phenoxyphenyl)-2-[[4-(2-thiophen-2-ylethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Openeye Name: 1-(4-phenoxyphenyl)-2-[[4-[2-(2-thienyl)ethyl]-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-(4-phenoxyphenyl)-2-[[4-(2-thiophen-2-ylethyl)-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-(4-phenoxyphenyl)-2-[[4-(2-thiophen-2-ylethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Traditional Name: 1-(4-phenoxyphenyl)-2-[[4-[2-(2-thienyl)ethyl]-1,2,4-triazol-3-yl]thio]ethanone Formula: C22H19N3O2S2 MolecularWeight: 421.53516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)CSC3=NN=CN3CCC4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)CSC3=NN=CN3CCC4=CC=CS4

InChI

InChI=1S/C22H19N3O2S2/c26-21(17-8-10-19(11-9-17)27-18-5-2-1-3-6-18)15-29-22-24-23-16-25(22)13-12-20-7-4-14-28-20/h1-11,14,16H,12-13,15H2