Vitas-M small molecule compound
propan-2-yl 5-carbamoyl-4-methyl-2-{[(pyrimidin-2-ylsulfanyl)acetyl]amino}thiophene-3-carboxylate
Catalog ID
STK495354
SMILES O=C(Nc1sc(c(c1C(=O)OC(C)C)C)C(=O)N)CSc1ncccn1
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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 C16H18N4O4S2 MW 394.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4O4S2/c1-8(2)24-15(23)11-9(3)12(13(17)22)26-14(11)20-10(21)7-25-16-18-5-4-6-19-16/h4-6,8H,7H2,1-3H3,(H2,17,22)(H,20,21)InChIKey
WRGXSSJGYDSJBF-UHFFFAOYSA-NSynonyms
CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)CSC2=NC=CC=N2)C(=O)N
InChI=1SC16H18N4O4S2c18(2)2415(23)119(3)12(13(17)22)2614(11)2010(21)72516185461916h468H7H213H3(H21722)(H2021)
MFCD06072295
propan2yl5carbamoyl4methyl2(((pyrimidin2ylsulfanyl)acetyl)amino)thiophene3carboxylate
propan2yl5carbamoyl4methyl2((2pyrimidin2ylsulfanylacetyl)amino)thiophene3carboxylate
ZINC000014067389
ZINC14067389
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