2-(2,5-dimethylpyrrol-1-yl)-1,3-benzothiazole

Systemtic Name: 2-(2,5-dimethylpyrrol-1-yl)-1,3-benzothiazole Openeye Name: 2-(2,5-dimethylpyrrol-1-yl)-1,3-benzothiazole CAS Name: 2-(2,5-dimethyl-1-pyrrolyl)-1,3-benzothiazole IUPAC Name: 2-(2,5-dimethylpyrrol-1-yl)-1,3-benzothiazole Traditional Name: 2-(2,5-dimethylpyrrol-1-yl)-1,3-benzothiazole Formula: C13H12N2S MolecularWeight: 228.31278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=NC3=CC=CC=C3S2)C

Isomeric SMILES

CC1=CC=C(N1C2=NC3=CC=CC=C3S2)C

InChI

InChI=1S/C13H12N2S/c1-9-7-8-10(2)15(9)13-14-11-5-3-4-6-12(11)16-13/h3-8H,1-2H3