N-(4-bromanyl-2-propan-2-yl-phenyl)-2-[[4-ethyl-5-(3-propan-2-yloxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-bromanyl-2-propan-2-yl-phenyl)-2-[[4-ethyl-5-(3-propan-2-yloxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(4-bromo-2-isopropyl-phenyl)-2-[[4-ethyl-5-(3-isopropoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(4-bromo-2-propan-2-ylphenyl)-2-[[4-ethyl-5-(3-propan-2-yloxyphenyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(4-bromo-2-propan-2-ylphenyl)-2-[[4-ethyl-5-(3-propan-2-yloxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(4-bromo-2-isopropyl-phenyl)-2-[[4-ethyl-5-(3-isopropoxyphenyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C24H29BrN4O2S MolecularWeight: 517.48166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=C(C=C(C=C2)Br)C(C)C)C3=CC(=CC=C3)OC(C)C

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=C(C=C(C=C2)Br)C(C)C)C3=CC(=CC=C3)OC(C)C

InChI

InChI=1S/C24H29BrN4O2S/c1-6-29-23(17-8-7-9-19(12-17)31-16(4)5)27-28-24(29)32-14-22(30)26-21-11-10-18(25)13-20(21)15(2)3/h7-13,15-16H,6,14H2,1-5H3,(H,26,30)