2-(1,3-benzoxazol-2-ylmethylsulfanyl)-4,6-dimethyl-pyridine-3-carbonitrile

Systemtic Name: 2-(1,3-benzoxazol-2-ylmethylsulfanyl)-4,6-dimethyl-pyridine-3-carbonitrile Openeye Name: 2-(1,3-benzoxazol-2-ylmethylsulfanyl)-4,6-dimethyl-pyridine-3-carbonitrile CAS Name: 2-(1,3-benzoxazol-2-ylmethylthio)-4,6-dimethyl-3-pyridinecarbonitrile IUPAC Name: 2-(1,3-benzoxazol-2-ylmethylsulfanyl)-4,6-dimethylpyridine-3-carbonitrile Traditional Name: 2-(1,3-benzoxazol-2-ylmethylthio)-4,6-dimethyl-nicotinonitrile Formula: C16H13N3OS MolecularWeight: 295.35892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC2=NC3=CC=CC=C3O2)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC2=NC3=CC=CC=C3O2)C

InChI

InChI=1S/C16H13N3OS/c1-10-7-11(2)18-16(12(10)8-17)21-9-15-19-13-5-3-4-6-14(13)20-15/h3-7H,9H2,1-2H3