2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxyethyl)-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxyethyl)-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxyethyl)acetamide CAS Name: 2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-N-(2-methoxyethyl)-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxyethyl)acetamide Traditional Name: N-benzyl-2-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-N-(2-methoxyethyl)acetamide Formula: C21H25N5O2S MolecularWeight: 411.5205

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)N(CCOC)CC2=CC=CC=C2)C3=CC=NC=C3

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)N(CCOC)CC2=CC=CC=C2)C3=CC=NC=C3

InChI

InChI=1S/C21H25N5O2S/c1-3-26-20(18-9-11-22-12-10-18)23-24-21(26)29-16-19(27)25(13-14-28-2)15-17-7-5-4-6-8-17/h4-12H,3,13-16H2,1-2H3