Vitas-M small molecule compound
ethyl 6-({[4-amino-5-(difluoromethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1-ethyl-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK313423
SMILES CCOC(=O)C1=C(CSc2nnc(n2N)C(F)F)N(C(=O)NC1c1ccccc1)CC
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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 C19H22F2N6O3S MW 452.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22F2N6O3S/c1-3-26-12(10-31-19-25-24-16(15(20)21)27(19)22)13(17(28)30-4-2)14(23-18(26)29)11-8-6-5-7-9-11/h5-9,14-15H,3-4,10,22H2,1-2H3,(H,23,29)InChIKey
HQZUBJSVSAOWME-UHFFFAOYSA-NSynonyms
832741-49-8832741498
CCN1C(=C(C(NC1=O)C2=CC=CC=C2)C(=O)OCC)CSC3=NN=C(N3N)C(F)F
ethyl4((4amino5(difluoromethyl)124triazol3yl)sulfanylmethyl)3ethyl2oxo6phenyl16dihydropyrimidine5carboxylate
ethyl6(((4amino5(difluoromethyl)4H124triazol3yl)sulfanyl)methyl)1ethyl2oxo4phenyl1234tetrahydropyrimidine5carboxylate
InChI=1SC19H22F2N6O3Sc132612(103119252416(15(20)21)27(19)22)13(17(28)3042)14(2318(26)29)118657911h591415H341022H212H3(H2329)
MFCD05667214
ZINC000002732245
ZINC000002732246
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