7-[methyl-(2-sulfanylidene-1H-[1,3]thiazolo[5,4-b]pyridin-5-yl)amino]-7-oxidanylidene-heptanoic acid

Systemtic Name: 7-[methyl-(2-sulfanylidene-1H-[1,3]thiazolo[5,4-b]pyridin-5-yl)amino]-7-oxidanylidene-heptanoic acid Openeye Name: 7-[methyl-(2-thioxo-1H-thiazolo[5,4-b]pyridin-5-yl)amino]-7-oxo-heptanoic acid CAS Name: 7-[methyl-(2-sulfanylidene-1H-thiazolo[5,4-b]pyridin-5-yl)amino]-7-oxoheptanoic acid IUPAC Name: 7-[methyl-(2-sulfanylidene-1H-[1,3]thiazolo[5,4-b]pyridin-5-yl)amino]-7-oxoheptanoic acid Traditional Name: 7-keto-7-[methyl-(2-thioxo-1H-thiazolo[5,4-b]pyridin-5-yl)amino]enanthic acid Formula: C14H17N3O3S2 MolecularWeight: 339.43308

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=NC2=C(C=C1)NC(=S)S2)C(=O)CCCCCC(=O)O

Isomeric SMILES

CN(C1=NC2=C(C=C1)NC(=S)S2)C(=O)CCCCCC(=O)O

InChI

InChI=1S/C14H17N3O3S2/c1-17(11(18)5-3-2-4-6-12(19)20)10-8-7-9-13(16-10)22-14(21)15-9/h7-8H,2-6H2,1H3,(H,15,21)(H,19,20)