2-(2-methanethioylpyrrol-1-yl)ethanoic acid

Systemtic Name: 2-(2-methanethioylpyrrol-1-yl)ethanoic acid Openeye Name: 2-(2-methanethioylpyrrol-1-yl)acetic acid CAS Name: 2-(2-methanethioyl-1-pyrrolyl)acetic acid IUPAC Name: 2-(2-methanethioylpyrrol-1-yl)acetic acid Traditional Name: 2-(2-thioformylpyrrol-1-yl)acetic acid Formula: C7H7NO2S MolecularWeight: 169.20098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=C1)C=S)CC(=O)O

Isomeric SMILES

C1=CN(C(=C1)C=S)CC(=O)O

InChI

InChI=1S/C7H7NO2S/c9-7(10)4-8-3-1-2-6(8)5-11/h1-3,5H,4H2,(H,9,10)