3-[(2-pyridin-3-ylbenzimidazol-1-yl)methyl]benzenecarbothioamide

Systemtic Name: 3-[(2-pyridin-3-ylbenzimidazol-1-yl)methyl]benzenecarbothioamide Openeye Name: 3-[[2-(3-pyridyl)benzimidazol-1-yl]methyl]benzenecarbothioamide CAS Name: 3-[[2-(3-pyridinyl)-1-benzimidazolyl]methyl]benzenecarbothioamide IUPAC Name: 3-[(2-pyridin-3-ylbenzimidazol-1-yl)methyl]benzenecarbothioamide Traditional Name: 3-[[2-(3-pyridyl)benzimidazol-1-yl]methyl]thiobenzamide Formula: C20H16N4S MolecularWeight: 344.43284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2CC3=CC=CC(=C3)C(=S)N)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2CC3=CC=CC(=C3)C(=S)N)C4=CN=CC=C4

InChI

InChI=1S/C20H16N4S/c21-19(25)15-6-3-5-14(11-15)13-24-18-9-2-1-8-17(18)23-20(24)16-7-4-10-22-12-16/h1-12H,13H2,(H2,21,25)