3-(6-bromanyl-2-oxidanylidene-1,3-benzothiazol-3-yl)propanenitrile

Systemtic Name: 3-(6-bromanyl-2-oxidanylidene-1,3-benzothiazol-3-yl)propanenitrile Openeye Name: 3-(6-bromo-2-oxo-1,3-benzothiazol-3-yl)propanenitrile CAS Name: 3-(6-bromo-2-oxo-1,3-benzothiazol-3-yl)propanenitrile IUPAC Name: 3-(6-bromo-2-oxo-1,3-benzothiazol-3-yl)propanenitrile Traditional Name: 3-(6-bromo-2-keto-1,3-benzothiazol-3-yl)propionitrile Formula: C10H7BrN2OS MolecularWeight: 283.14438

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)SC(=O)N2CCC#N

Isomeric SMILES

C1=CC2=C(C=C1Br)SC(=O)N2CCC#N

InChI

InChI=1S/C10H7BrN2OS/c11-7-2-3-8-9(6-7)15-10(14)13(8)5-1-4-12/h2-3,6H,1,5H2