Vitas-M small molecule compound
3-amino-2-[(2-ethyl-6-methylphenyl)carbamoyl]-6-oxo-6,7-dihydrothieno[2,3-b]pyridine-5-carboxylic acid
Catalog ID
STK826776
SMILES CCc1cccc(c1NC(=O)c1sc2c(c1N)cc(c(=O)[nH]2)C(=O)O)C
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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 C18H17N3O4S MW 371.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O4S/c1-3-9-6-4-5-8(2)13(9)20-16(23)14-12(19)10-7-11(18(24)25)15(22)21-17(10)26-14/h4-7H,3,19H2,1-2H3,(H,20,23)(H,21,22)(H,24,25)InChIKey
KOUHAMISLWQLSV-UHFFFAOYSA-NSynonyms
3amino2((2ethyl6methylphenyl)carbamoyl)6oxo67dihydrothieno(23b)pyridine5carboxylicacid
3AMINO2((2ETHYL6METHYLPHENYL)CARBAMOYL)6OXO7HTHIENO(23B)PYRIDINE5CARBOXYLICACID
CCC1=CC=CC(=C1NC(=O)C2=C(C3=C(S2)NC(=O)C(=C3)C(=O)O)N)C
CCc1cccc(c1NC(=O)c1sc2c(c1N)cc(c(=O)(nH)2)C(=O)O)C
InChI=1SC18H17N3O4Sc1396458(2)13(9)2016(23)1412(19)10711(18(24)25)15(22)2117(10)2614h47H319H212H3(H2023)(H2122)(H2425)
MFCD04440996
ZINC000002694768
ZINC2694768
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