Vitas-M small molecule compound
ethyl 2-(1,3-benzoxazol-2-ylamino)-4-methyl-6-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}pyrimidine-5-carboxylate
Catalog ID
STK210095
SMILES CCOC(=O)c1c(CSc2nnnn2c2ccccc2)nc(nc1C)Nc1nc2c(o1)cccc2
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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 C23H20N8O3S MW 488.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N8O3S/c1-3-33-20(32)19-14(2)24-21(27-22-26-16-11-7-8-12-18(16)34-22)25-17(19)13-35-23-28-29-30-31(23)15-9-5-4-6-10-15/h4-12H,3,13H2,1-2H3,(H,24,25,26,27)InChIKey
LPWJOVYMIHJFSZ-UHFFFAOYSA-NSynonyms
878973-66-1CCOC(=O)C1=C(N=C(N=C1CSC2=NN=NN2C3=CC=CC=C3)NC4=NC5=CC=CC=C5O4)C
ethyl2(13benzoxazol2ylamino)4methyl6(((1phenyl1Htetrazol5yl)sulfanyl)methyl)pyrimidine5carboxylate
ETHYL2(13BENZOXAZOL2YLAMINO)4METHYL6((1PHENYLTETRAZOL5YL)SULFANYLMETHYL)PYRIMIDINE5CARBOXYLATE
ethyl2(benzo(d)oxazol2ylamino)4methyl6(((1phenyl1Htetrazol5yl)thio)methyl)pyrimidine5carboxylate
InChI=1SC23H20N8O3Sc133320(32)1914(2)2421(2722261611781218(16)3422)2517(19)13352328293031(23)1595461015h412H313H212H3(H24252627)
MFCD05844013
ZINC08743063
ZINC8743063
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