Vitas-M small molecule compound
methyl (2E)-{[5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}[2-(3-methylphenyl)hydrazinylidene]ethanoate
Catalog ID
STK999340
SMILES COC(=O)/C(=N\Nc1cccc(c1)C)/Sc1nnc(n1C)c1ccc(cc1)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 C20H21N5O3S MW 411.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O3S/c1-13-6-5-7-15(12-13)21-23-18(19(26)28-4)29-20-24-22-17(25(20)2)14-8-10-16(27-3)11-9-14/h5-12,21H,1-4H3/b23-18+InChIKey
ZVUWLECZEQBXHQ-PTGBLXJZSA-NSynonyms
668439-09-6(E)methyl2((5(4methoxyphenyl)4methyl4H124triazol3yl)thio)2(2(mtolyl)hydrazono)acetate
668439096
CC1=CC(=CC=C1)NN=C(C(=O)OC)SC2=NN=C(N2C)C3=CC=C(C=C3)OC
COC(=O)C(=NNc1cccc(c1)C)Sc1nnc(n1C)c1ccc(cc1)OC
InChI=1SC20H21N5O3Sc11365715(1213)212318(19(26)284)2920242217(25(20)2)1481016(273)11914h51221H14H3b2318+
methyl(2E)((5(4methoxyphenyl)4methyl4H124triazol3yl)sulfanyl)(2(3methylphenyl)hydrazinylidene)ethanoate
METHYL(2E)2((5(4METHOXYPHENYL)4METHYL124TRIAZOL3YL)SULFANYL)2((3METHYLPHENYL)HYDRAZINYLIDENE)ACETATE
MFCD03672488
ZINC000002206671
ZINC33350389
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