Vitas-M small molecule compound
methyl 1-{[(4-{[(Z)-{5-[(4-ethoxyphenoxy)methyl]furan-2-yl}methylidene]amino}-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-pyrazole-3-carboxylate
Catalog ID
STK314339
SMILES CCOc1ccc(cc1)OCc1ccc(o1)/C=N\n1cnnc1SCn1ccc(n1)C(=O)OC
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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 C22H22N6O5S MW 482.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N6O5S/c1-3-31-16-4-6-17(7-5-16)32-13-19-9-8-18(33-19)12-24-28-14-23-25-22(28)34-15-27-11-10-20(26-27)21(29)30-2/h4-12,14H,3,13,15H2,1-2H3/b24-12-InChIKey
OTQFDKBVXINCFE-MSXFZWOLSA-NSynonyms
1005592-86-81005592868
CCOC1=CC=C(C=C1)OCC2=CC=C(O2)C=NN3C=NN=C3SCN4C=CC(=N4)C(=O)OC
CCOc1ccc(cc1)OCc1ccc(o1)C=Nn1cnnc1SCn1ccc(n1)C(=O)OC
InChI=1SC22H22N6O5Sc1331164617(7516)3213199818(3319)12242814232522(28)341527111020(2627)21(29)302h41214H31315H212H3b2412
methyl1(((4(((Z)(5((4ethoxyphenoxy)methyl)furan2yl)methylidene)amino)4H124triazol3yl)sulfanyl)methyl)1Hpyrazole3carboxylate
methyl1((4((Z)(5((4ethoxyphenoxy)methyl)furan2yl)methylideneamino)124triazol3yl)sulfanylmethyl)pyrazole3carboxylate
MFCD05667725
ZINC000002733789
ZINC2733790
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