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

Systemtic Name: 2-(2-methanoylpyrrol-1-yl)-1,3-benzothiazole-6-carbonitrile Openeye Name: 2-(2-formylpyrrol-1-yl)-1,3-benzothiazole-6-carbonitrile CAS Name: 2-(2-formyl-1-pyrrolyl)-1,3-benzothiazole-6-carbonitrile IUPAC Name: 2-(2-formylpyrrol-1-yl)-1,3-benzothiazole-6-carbonitrile Traditional Name: 2-(2-formylpyrrol-1-yl)-1,3-benzothiazole-6-carbonitrile Formula: C13H7N3OS MolecularWeight: 253.27918

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=C1)C=O)C2=NC3=C(S2)C=C(C=C3)C#N

Isomeric SMILES

C1=CN(C(=C1)C=O)C2=NC3=C(S2)C=C(C=C3)C#N

InChI

InChI=1S/C13H7N3OS/c14-7-9-3-4-11-12(6-9)18-13(15-11)16-5-1-2-10(16)8-17/h1-6,8H