7-chloranyl-5-isothiocyanato-2-pyridin-3-yl-1,3-benzoxazole

Systemtic Name: 7-chloranyl-5-isothiocyanato-2-pyridin-3-yl-1,3-benzoxazole Openeye Name: 7-chloro-5-isothiocyanato-2-(3-pyridyl)-1,3-benzoxazole CAS Name: 7-chloro-5-isothiocyanato-2-(3-pyridinyl)-1,3-benzoxazole IUPAC Name: 7-chloro-5-isothiocyanato-2-pyridin-3-yl-1,3-benzoxazole Traditional Name: 7-chloro-5-isothiocyanato-2-(3-pyridyl)-1,3-benzoxazole Formula: C13H6ClN3OS MolecularWeight: 287.72424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=NC3=CC(=CC(=C3O2)Cl)N=C=S

Isomeric SMILES

C1=CC(=CN=C1)C2=NC3=CC(=CC(=C3O2)Cl)N=C=S

InChI

InChI=1S/C13H6ClN3OS/c14-10-4-9(16-7-19)5-11-12(10)18-13(17-11)8-2-1-3-15-6-8/h1-6H