2-[1-(phenylmethyl)benzimidazol-2-yl]sulfanyl-N-[(E)-1-pyridin-3-ylethylideneamino]ethanamide

Systemtic Name: 2-[1-(phenylmethyl)benzimidazol-2-yl]sulfanyl-N-[(E)-1-pyridin-3-ylethylideneamino]ethanamide Openeye Name: 2-(1-benzylbenzimidazol-2-yl)sulfanyl-N-[(E)-1-(3-pyridyl)ethylideneamino]acetamide CAS Name: 2-[[1-(phenylmethyl)-2-benzimidazolyl]thio]-N-[(E)-1-(3-pyridinyl)ethylideneamino]acetamide IUPAC Name: 2-(1-benzylbenzimidazol-2-yl)sulfanyl-N-[(E)-1-pyridin-3-ylethylideneamino]acetamide Traditional Name: 2-[(1-benzylbenzimidazol-2-yl)thio]-N-[(E)-1-(3-pyridyl)ethylideneamino]acetamide Formula: C23H21N5OS MolecularWeight: 415.51074

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CSC1=NC2=CC=CC=C2N1CC3=CC=CC=C3)C4=CN=CC=C4

Isomeric SMILES

C/C(=N\NC(=O)CSC1=NC2=CC=CC=C2N1CC3=CC=CC=C3)/C4=CN=CC=C4

InChI

InChI=1S/C23H21N5OS/c1-17(19-10-7-13-24-14-19)26-27-22(29)16-30-23-25-20-11-5-6-12-21(20)28(23)15-18-8-3-2-4-9-18/h2-14H,15-16H2,1H3,(H,27,29)/b26-17+