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

Systemtic Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-[(2,4-dimethylanilino)-oxomethyl]-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C20H22N6O2S MolecularWeight: 410.49268

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC(=O)NC2=C(C=C(C=C2)C)C)C3=CC=NC=C3

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC(=O)NC2=C(C=C(C=C2)C)C)C3=CC=NC=C3

InChI

InChI=1S/C20H22N6O2S/c1-4-26-18(15-7-9-21-10-8-15)24-25-20(26)29-12-17(27)23-19(28)22-16-6-5-13(2)11-14(16)3/h5-11H,4,12H2,1-3H3,(H2,22,23,27,28)