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

Systemtic Name: 2-[[5,6-bis(4-methoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-[[5,6-bis(4-methoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[[5,6-bis(4-methoxyphenyl)-1,2,4-triazin-3-yl]thio]-N-phenethylacetamide IUPAC Name: 2-[[5,6-bis(4-methoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-phenethylacetamide Traditional Name: 2-[[5,6-bis(4-methoxyphenyl)-1,2,4-triazin-3-yl]thio]-N-phenethyl-acetamide Formula: C27H26N4O3S MolecularWeight: 486.58534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(N=NC(=N2)SCC(=O)NCCC3=CC=CC=C3)C4=CC=C(C=C4)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(N=NC(=N2)SCC(=O)NCCC3=CC=CC=C3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H26N4O3S/c1-33-22-12-8-20(9-13-22)25-26(21-10-14-23(34-2)15-11-21)30-31-27(29-25)35-18-24(32)28-17-16-19-6-4-3-5-7-19/h3-15H,16-18H2,1-2H3,(H,28,32)