5-chloranyl-2-(pyridin-3-ylmethylsulfanyl)-1,3-benzoxazole

Systemtic Name: 5-chloranyl-2-(pyridin-3-ylmethylsulfanyl)-1,3-benzoxazole Openeye Name: 5-chloro-2-(3-pyridylmethylsulfanyl)-1,3-benzoxazole CAS Name: 5-chloro-2-(3-pyridinylmethylthio)-1,3-benzoxazole IUPAC Name: 5-chloro-2-(pyridin-3-ylmethylsulfanyl)-1,3-benzoxazole Traditional Name: 5-chloro-2-(3-pyridylmethylthio)-1,3-benzoxazole Formula: C13H9ClN2OS MolecularWeight: 276.74136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CSC2=NC3=C(O2)C=CC(=C3)Cl

Isomeric SMILES

C1=CC(=CN=C1)CSC2=NC3=C(O2)C=CC(=C3)Cl

InChI

InChI=1S/C13H9ClN2OS/c14-10-3-4-12-11(6-10)16-13(17-12)18-8-9-2-1-5-15-7-9/h1-7H,8H2