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

Systemtic Name: 2-[[5,6-bis(3-ethoxy-4-methoxy-phenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-cyclopentyl-ethanamide Openeye Name: 2-[[5,6-bis(3-ethoxy-4-methoxy-phenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-cyclopentyl-acetamide CAS Name: 2-[[5,6-bis(3-ethoxy-4-methoxyphenyl)-1,2,4-triazin-3-yl]thio]-N-cyclopentylacetamide IUPAC Name: 2-[[5,6-bis(3-ethoxy-4-methoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-cyclopentylacetamide Traditional Name: 2-[[5,6-bis(3-ethoxy-4-methoxy-phenyl)-1,2,4-triazin-3-yl]thio]-N-cyclopentyl-acetamide Formula: C28H34N4O5S MolecularWeight: 538.65836

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2=C(N=NC(=N2)SCC(=O)NC3CCCC3)C4=CC(=C(C=C4)OC)OCC)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2=C(N=NC(=N2)SCC(=O)NC3CCCC3)C4=CC(=C(C=C4)OC)OCC)OC

InChI

InChI=1S/C28H34N4O5S/c1-5-36-23-15-18(11-13-21(23)34-3)26-27(19-12-14-22(35-4)24(16-19)37-6-2)31-32-28(30-26)38-17-25(33)29-20-9-7-8-10-20/h11-16,20H,5-10,17H2,1-4H3,(H,29,33)