2-[[4-(phenylmethyl)-5-(3-propan-2-yloxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-pyridin-2-yl-ethanamide

Systemtic Name: 2-[[4-(phenylmethyl)-5-(3-propan-2-yloxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-pyridin-2-yl-ethanamide Openeye Name: 2-[[4-benzyl-5-(3-isopropoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-pyridyl)acetamide CAS Name: 2-[[4-(phenylmethyl)-5-(3-propan-2-yloxyphenyl)-1,2,4-triazol-3-yl]thio]-N-(2-pyridinyl)acetamide IUPAC Name: 2-[[4-benzyl-5-(3-propan-2-yloxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-pyridin-2-ylacetamide Traditional Name: 2-[[4-benzyl-5-(3-isopropoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-(2-pyridyl)acetamide Formula: C25H25N5O2S MolecularWeight: 459.5633

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C2=NN=C(N2CC3=CC=CC=C3)SCC(=O)NC4=CC=CC=N4

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C2=NN=C(N2CC3=CC=CC=C3)SCC(=O)NC4=CC=CC=N4

InChI

InChI=1S/C25H25N5O2S/c1-18(2)32-21-12-8-11-20(15-21)24-28-29-25(30(24)16-19-9-4-3-5-10-19)33-17-23(31)27-22-13-6-7-14-26-22/h3-15,18H,16-17H2,1-2H3,(H,26,27,31)