N-(2-ethoxyphenyl)-2-(4-prop-2-enyl-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)ethanamide

Systemtic Name: N-(2-ethoxyphenyl)-2-(4-prop-2-enyl-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)ethanamide Openeye Name: 2-[4-allyl-3-(4-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]-N-(2-ethoxyphenyl)acetamide CAS Name: N-(2-ethoxyphenyl)-2-(4-prop-2-enyl-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)acetamide IUPAC Name: N-(2-ethoxyphenyl)-2-(4-prop-2-enyl-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)acetamide Traditional Name: 2-[4-allyl-3-(4-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]-N-o-phenetyl-acetamide Formula: C20H21N5O2S MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)CN2C(=S)N(C(=N2)C3=CC=NC=C3)CC=C

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)CN2C(=S)N(C(=N2)C3=CC=NC=C3)CC=C

InChI

InChI=1S/C20H21N5O2S/c1-3-13-24-19(15-9-11-21-12-10-15)23-25(20(24)28)14-18(26)22-16-7-5-6-8-17(16)27-4-2/h3,5-12H,1,4,13-14H2,2H3,(H,22,26)