4-[3-(dimethylamino)propylamino]-2-methyl-6-sulfanylidene-1H-pyridine-3-carboxylic acid

Systemtic Name: 4-[3-(dimethylamino)propylamino]-2-methyl-6-sulfanylidene-1H-pyridine-3-carboxylic acid Openeye Name: 4-[3-(dimethylamino)propylamino]-2-methyl-6-thioxo-1H-pyridine-3-carboxylic acid CAS Name: 4-[3-(dimethylamino)propylamino]-2-methyl-6-sulfanylidene-1H-pyridine-3-carboxylic acid IUPAC Name: 4-[3-(dimethylamino)propylamino]-2-methyl-6-sulfanylidene-1H-pyridine-3-carboxylic acid Traditional Name: 4-[3-(dimethylamino)propylamino]-2-methyl-6-thioxo-1H-pyridine-3-carboxylic acid Formula: C12H19N3O2S MolecularWeight: 269.36316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=S)N1)NCCCN(C)C)C(=O)O

Isomeric SMILES

CC1=C(C(=CC(=S)N1)NCCCN(C)C)C(=O)O

InChI

InChI=1S/C12H19N3O2S/c1-8-11(12(16)17)9(7-10(18)14-8)13-5-4-6-15(2)3/h7H,4-6H2,1-3H3,(H,16,17)(H2,13,14,18)