Vitas-M small molecule compound
propyl 2-({[7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK960733
SMILES CCCOC(=O)c1c(NC(=O)c2nn3c(n2)nc(cc3C(F)F)C)sc2c1CCCC2
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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 C20H21F2N5O3S MW 449.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21F2N5O3S/c1-3-8-30-19(29)14-11-6-4-5-7-13(11)31-18(14)25-17(28)16-24-20-23-10(2)9-12(15(21)22)27(20)26-16/h9,15H,3-8H2,1-2H3,(H,25,28)InChIKey
OBRYRFAGIHJZOD-UHFFFAOYSA-NSynonyms
445035-41-6445035416
CCCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=NN4C(=CC(=NC4=N3)C)C(F)F
InChI=1SC20H21F2N5O3Sc1383019(29)1411645713(11)3118(14)2517(28)1624202310(2)912(15(21)22)27(20)2616h915H38H212H3(H2528)
MFCD02175776
propyl2(((7(difluoromethyl)5methyl(124)triazolo(15a)pyrimidin2yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
propyl2((7(difluoromethyl)5methyl(124)triazolo(15a)pyrimidine2carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ZINC000002489061
ZINC02489061
ZINC2489061
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