4-(2,5-dimethylpyrrol-1-yl)benzenethiol

Systemtic Name: 4-(2,5-dimethylpyrrol-1-yl)benzenethiol Openeye Name: 4-(2,5-dimethylpyrrol-1-yl)benzenethiol CAS Name: 4-(2,5-dimethyl-1-pyrrolyl)benzenethiol IUPAC Name: 4-(2,5-dimethylpyrrol-1-yl)benzenethiol Traditional Name: 4-(2,5-dimethylpyrrol-1-yl)benzenethiol Formula: C12H13NS MolecularWeight: 203.30332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)S)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)S)C

InChI

InChI=1S/C12H13NS/c1-9-3-4-10(2)13(9)11-5-7-12(14)8-6-11/h3-8,14H,1-2H3