2-[[5,6-bis(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-(2-chlorophenyl)ethanamide

Systemtic Name: 2-[[5,6-bis(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-(2-chlorophenyl)ethanamide Openeye Name: 2-[[5,6-bis(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-(2-chlorophenyl)acetamide CAS Name: 2-[[5,6-bis(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]thio]-N-(2-chlorophenyl)acetamide IUPAC Name: 2-[[5,6-bis(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-(2-chlorophenyl)acetamide Traditional Name: 2-[[5,6-bis(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]thio]-N-(2-chlorophenyl)acetamide Formula: C27H25ClN4O5S MolecularWeight: 553.0292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(N=NC(=N2)SCC(=O)NC3=CC=CC=C3Cl)C4=CC(=C(C=C4)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(N=NC(=N2)SCC(=O)NC3=CC=CC=C3Cl)C4=CC(=C(C=C4)OC)OC)OC

InChI

InChI=1S/C27H25ClN4O5S/c1-34-20-11-9-16(13-22(20)36-3)25-26(17-10-12-21(35-2)23(14-17)37-4)31-32-27(30-25)38-15-24(33)29-19-8-6-5-7-18(19)28/h5-14H,15H2,1-4H3,(H,29,33)