2-[2-(pyridin-2-ylmethylsulfanyl)-3H-benzimidazol-5-yl]-4,5-dihydro-1,3-oxazole

Systemtic Name: 2-[2-(pyridin-2-ylmethylsulfanyl)-3H-benzimidazol-5-yl]-4,5-dihydro-1,3-oxazole Openeye Name: 2-[2-(2-pyridylmethylsulfanyl)-3H-benzimidazol-5-yl]-4,5-dihydrooxazole CAS Name: 2-[2-(2-pyridinylmethylthio)-3H-benzimidazol-5-yl]-4,5-dihydrooxazole IUPAC Name: 2-[2-(pyridin-2-ylmethylsulfanyl)-3H-benzimidazol-5-yl]-4,5-dihydro-1,3-oxazole Traditional Name: 2-[2-(2-pyridylmethylthio)-3H-benzimidazol-5-yl]-2-oxazoline Formula: C16H14N4OS MolecularWeight: 310.37356

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=N1)C2=CC3=C(C=C2)N=C(N3)SCC4=CC=CC=N4

Isomeric SMILES

C1COC(=N1)C2=CC3=C(C=C2)N=C(N3)SCC4=CC=CC=N4

InChI

InChI=1S/C16H14N4OS/c1-2-6-17-12(3-1)10-22-16-19-13-5-4-11(9-14(13)20-16)15-18-7-8-21-15/h1-6,9H,7-8,10H2,(H,19,20)