2-[[5,6-bis(3-ethoxy-4-methoxy-phenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-cyclohexyl-ethanamide

Systemtic Name: 2-[[5,6-bis(3-ethoxy-4-methoxy-phenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-cyclohexyl-ethanamide Openeye Name: 2-[[5,6-bis(3-ethoxy-4-methoxy-phenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-cyclohexyl-acetamide CAS Name: 2-[[5,6-bis(3-ethoxy-4-methoxyphenyl)-1,2,4-triazin-3-yl]thio]-N-cyclohexylacetamide IUPAC Name: 2-[[5,6-bis(3-ethoxy-4-methoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-cyclohexylacetamide Traditional Name: 2-[[5,6-bis(3-ethoxy-4-methoxy-phenyl)-1,2,4-triazin-3-yl]thio]-N-cyclohexyl-acetamide Formula: C29H36N4O5S MolecularWeight: 552.68494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2=C(N=NC(=N2)SCC(=O)NC3CCCCC3)C4=CC(=C(C=C4)OC)OCC)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2=C(N=NC(=N2)SCC(=O)NC3CCCCC3)C4=CC(=C(C=C4)OC)OCC)OC

InChI

InChI=1S/C29H36N4O5S/c1-5-37-24-16-19(12-14-22(24)35-3)27-28(20-13-15-23(36-4)25(17-20)38-6-2)32-33-29(31-27)39-18-26(34)30-21-10-8-7-9-11-21/h12-17,21H,5-11,18H2,1-4H3,(H,30,34)