4-bromanyl-2-(2-methanoylpyrrol-1-yl)-1,3-benzothiazole-6-carbonitrile

Systemtic Name: 4-bromanyl-2-(2-methanoylpyrrol-1-yl)-1,3-benzothiazole-6-carbonitrile Openeye Name: 4-bromo-2-(2-formylpyrrol-1-yl)-1,3-benzothiazole-6-carbonitrile CAS Name: 4-bromo-2-(2-formyl-1-pyrrolyl)-1,3-benzothiazole-6-carbonitrile IUPAC Name: 4-bromo-2-(2-formylpyrrol-1-yl)-1,3-benzothiazole-6-carbonitrile Traditional Name: 4-bromo-2-(2-formylpyrrol-1-yl)-1,3-benzothiazole-6-carbonitrile Formula: C13H6BrN3OS MolecularWeight: 332.17524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=C1)C=O)C2=NC3=C(S2)C=C(C=C3Br)C#N

Isomeric SMILES

C1=CN(C(=C1)C=O)C2=NC3=C(S2)C=C(C=C3Br)C#N

InChI

InChI=1S/C13H6BrN3OS/c14-10-4-8(6-15)5-11-12(10)16-13(19-11)17-3-1-2-9(17)7-18/h1-5,7H