2-methyl-3-(2-oxidanylidene-1,3-benzothiazol-3-yl)propanenitrile

Systemtic Name: 2-methyl-3-(2-oxidanylidene-1,3-benzothiazol-3-yl)propanenitrile Openeye Name: 2-methyl-3-(2-oxo-1,3-benzothiazol-3-yl)propanenitrile CAS Name: 2-methyl-3-(2-oxo-1,3-benzothiazol-3-yl)propanenitrile IUPAC Name: 2-methyl-3-(2-oxo-1,3-benzothiazol-3-yl)propanenitrile Traditional Name: 3-(2-keto-1,3-benzothiazol-3-yl)-2-methyl-propionitrile Formula: C11H10N2OS MolecularWeight: 218.2749

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C2=CC=CC=C2SC1=O)C#N

Isomeric SMILES

CC(CN1C2=CC=CC=C2SC1=O)C#N

InChI

InChI=1S/C11H10N2OS/c1-8(6-12)7-13-9-4-2-3-5-10(9)15-11(13)14/h2-5,8H,7H2,1H3