Vitas-M small molecule compound
methyl 2-({[(3-carbamoyl-5,7-dihydroxythieno[3,2-b]pyridin-2-yl)sulfanyl]acetyl}amino)benzoate
Catalog ID
STK938247
SMILES COC(=O)c1ccccc1NC(=O)CSc1sc2c(c1C(=O)N)nc(cc2O)O
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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 C18H15N3O6S2 MW 433.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N3O6S2/c1-27-17(26)8-4-2-3-5-9(8)20-12(24)7-28-18-13(16(19)25)14-15(29-18)10(22)6-11(23)21-14/h2-6H,7H2,1H3,(H2,19,25)(H,20,24)(H2,21,22,23)InChIKey
VAIYKJVCRPZBPA-UHFFFAOYSA-NSynonyms
1189310-46-01189310460
COC(=O)C1=CC=CC=C1NC(=O)CSC2=C(C3=C(S2)C(=CC(=O)N3)O)C(=O)N
InChI=1SC18H15N3O6S2c12717(26)842359(8)2012(24)7281813(16(19)25)1415(2918)10(22)611(23)2114h26H7H21H3(H21925)(H2024)(H2212223)
methyl2((((3carbamoyl57dihydroxythieno(32b)pyridin2yl)sulfanyl)acetyl)amino)benzoate
methyl2((2((3carbamoyl7hydroxy5oxo4Hthieno(32b)pyridin2yl)sulfanyl)acetyl)amino)benzoate
METHYL2(2(3CARBAMOYL7HYDROXY5OXO4HYDROTHIOPHENO(45B)PYRIDIN2YLTHIO)ACETYLAMINO)BENZOATE
MFCD18178903
ZINC000036367045
ZINC36367045
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