N-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(1,3-dimethyl-2-oxo-benzimidazol-5-yl)-2-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(1,3-dimethyl-2-oxo-5-benzimidazolyl)-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-N-(2-keto-1,3-dimethyl-benzimidazol-5-yl)acetamide Formula: C20H21N7O2S MolecularWeight: 423.49144

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=CC3=C(C=C2)N(C(=O)N3C)C)C4=CC=NC=C4

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=CC3=C(C=C2)N(C(=O)N3C)C)C4=CC=NC=C4

InChI

InChI=1S/C20H21N7O2S/c1-4-27-18(13-7-9-21-10-8-13)23-24-19(27)30-12-17(28)22-14-5-6-15-16(11-14)26(3)20(29)25(15)2/h5-11H,4,12H2,1-3H3,(H,22,28)