phenyl-[2-(pyridin-3-ylmethylsulfanyl)-3H-benzimidazol-5-yl]methanone

Systemtic Name: phenyl-[2-(pyridin-3-ylmethylsulfanyl)-3H-benzimidazol-5-yl]methanone Openeye Name: phenyl-[2-(3-pyridylmethylsulfanyl)-3H-benzimidazol-5-yl]methanone CAS Name: phenyl-[2-(3-pyridinylmethylthio)-3H-benzimidazol-5-yl]methanone IUPAC Name: phenyl-[2-(pyridin-3-ylmethylsulfanyl)-3H-benzimidazol-5-yl]methanone Traditional Name: phenyl-[2-(3-pyridylmethylthio)-3H-benzimidazol-5-yl]methanone Formula: C20H15N3OS MolecularWeight: 345.4176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC3=C(C=C2)N=C(N3)SCC4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC3=C(C=C2)N=C(N3)SCC4=CN=CC=C4

InChI

InChI=1S/C20H15N3OS/c24-19(15-6-2-1-3-7-15)16-8-9-17-18(11-16)23-20(22-17)25-13-14-5-4-10-21-12-14/h1-12H,13H2,(H,22,23)