2-[2-[[4-ethyl-5-(2-phenylcyclopropyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]benzamide

Systemtic Name: 2-[2-[[4-ethyl-5-(2-phenylcyclopropyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]benzamide Openeye Name: 2-[[2-[[4-ethyl-5-(2-phenylcyclopropyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide CAS Name: 2-[[2-[[4-ethyl-5-(2-phenylcyclopropyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: 2-[[2-[[4-ethyl-5-(2-phenylcyclopropyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide Traditional Name: 2-[[2-[[4-ethyl-5-(2-phenylcyclopropyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]benzamide Formula: C22H23N5O2S MolecularWeight: 421.51532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2C(=O)N)C3CC3C4=CC=CC=C4

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2C(=O)N)C3CC3C4=CC=CC=C4

InChI

InChI=1S/C22H23N5O2S/c1-2-27-21(17-12-16(17)14-8-4-3-5-9-14)25-26-22(27)30-13-19(28)24-18-11-7-6-10-15(18)20(23)29/h3-11,16-17H,2,12-13H2,1H3,(H2,23,29)(H,24,28)