2-(3-azanyl-3-oxidanylidene-propyl)sulfanylpyridine-3-carboxylic acid

Systemtic Name: 2-(3-azanyl-3-oxidanylidene-propyl)sulfanylpyridine-3-carboxylic acid Openeye Name: 2-(3-amino-3-oxo-propyl)sulfanylpyridine-3-carboxylic acid CAS Name: 2-[(3-amino-3-oxopropyl)thio]-3-pyridinecarboxylic acid IUPAC Name: 2-(3-amino-3-oxopropyl)sulfanylpyridine-3-carboxylic acid Traditional Name: 2-[(3-amino-3-keto-propyl)thio]nicotinic acid Formula: C9H10N2O3S MolecularWeight: 226.2523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SCCC(=O)N)C(=O)O

Isomeric SMILES

C1=CC(=C(N=C1)SCCC(=O)N)C(=O)O

InChI

InChI=1S/C9H10N2O3S/c10-7(12)3-5-15-8-6(9(13)14)2-1-4-11-8/h1-2,4H,3,5H2,(H2,10,12)(H,13,14)