Vitas-M small molecule compound

3-amino-2-[(2,6-dimethylphenyl)carbamoyl]-6-hydroxythieno[2,3-b]pyridine-5-carboxylic acid

Catalog ID
STK642852
SMILES O=C(c1sc2c(c1N)cc(c(n2)O)C(=O)O)Nc1c(C)cccc1C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C17H15N3O4S MW 357.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N3O4S/c1-7-4-3-5-8(2)12(7)19-15(22)13-11(18)9-6-10(17(23)24)14(21)20-16(9)25-13/h3-6H,18H2,1-2H3,(H,19,22)(H,20,21)(H,23,24)
InChIKey
ZUCOPSGCNKSNET-UHFFFAOYSA-N
Synonyms
497229-20-6
3AMINO2((26DIMETHYLPHENYL)CARBAMOYL)6HYDROXYTHIENO(23B)PYRIDINE5CARBOXYLICACID
3AMINO2((26DIMETHYLPHENYL)CARBAMOYL)6OXO67DIHYDROTHIENO(23B)PYRIDINE5CARBOXYLICACID
3AMINO2((26DIMETHYLPHENYL)CARBAMOYL)6OXO7HTHIENO(23B)PYRIDINE5CARBOXYLICACID
3AMINO2(N(26DIMETHYLPHENYL)CARBAMOYL)6OXO7HYDROTHIOPHENO(23B)PYRIDINE5CARBOXYLICACID
CC1=C(C(=CC=C1)C)NC(=O)C2=C(C3=C(S2)NC(=O)C(=C3)C(=O)O)N
InChI=1SC17H15N3O4Sc174358(2)12(7)1915(22)1311(18)9610(17(23)24)14(21)2016(9)2513h36H18H212H3(H1922)(H2021)(H2324)
MFCD18163110
ZINC2343569

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Available files

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