N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-2-[[4-(4-ethoxyphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-2-[[4-(4-ethoxyphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-[(E)-(3,4-dimethoxyphenyl)methyleneamino]-2-[[4-(4-ethoxyphenyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-2-[[4-(4-ethoxyphenyl)-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-2-[[4-(4-ethoxyphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-p-phenetyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-[(E)-veratrylideneamino]acetamide Formula: C26H26N6O4S MolecularWeight: 518.58744

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN=CC3=CC(=C(C=C3)OC)OC)C4=CN=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)N/N=C/C3=CC(=C(C=C3)OC)OC)C4=CN=CC=C4

InChI

InChI=1S/C26H26N6O4S/c1-4-36-21-10-8-20(9-11-21)32-25(19-6-5-13-27-16-19)30-31-26(32)37-17-24(33)29-28-15-18-7-12-22(34-2)23(14-18)35-3/h5-16H,4,17H2,1-3H3,(H,29,33)/b28-15+