N-(1,3-diethyl-2-oxidanylidene-benzimidazol-5-yl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(1,3-diethyl-2-oxidanylidene-benzimidazol-5-yl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(1,3-diethyl-2-oxo-benzimidazol-5-yl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(1,3-diethyl-2-oxo-5-benzimidazolyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(1,3-diethyl-2-oxobenzimidazol-5-yl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(1,3-diethyl-2-keto-benzimidazol-5-yl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C21H22N6O2S MolecularWeight: 422.50338

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)CSC3=NNC(=N3)C4=CC=CC=C4)N(C1=O)CC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)CSC3=NNC(=N3)C4=CC=CC=C4)N(C1=O)CC

InChI

InChI=1S/C21H22N6O2S/c1-3-26-16-11-10-15(12-17(16)27(4-2)21(26)29)22-18(28)13-30-20-23-19(24-25-20)14-8-6-5-7-9-14/h5-12H,3-4,13H2,1-2H3,(H,22,28)(H,23,24,25)