Vitas-M small molecule compound
N-{[5-({2-[(5-chloro-2-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]methyl}-3,4-dimethoxybenzamide
Catalog ID
STK114913
SMILES COc1cc(ccc1OC)C(=O)NCc1nnc(n1C)SCC(=O)Nc1cc(Cl)ccc1OC
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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 C22H24ClN5O5S MW 505.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24ClN5O5S/c1-28-19(11-24-21(30)13-5-7-17(32-3)18(9-13)33-4)26-27-22(28)34-12-20(29)25-15-10-14(23)6-8-16(15)31-2/h5-10H,11-12H2,1-4H3,(H,24,30)(H,25,29)InChIKey
CXYWRKBCSSTXGH-UHFFFAOYSA-NSynonyms
CN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)Cl)OC)CNC(=O)C3=CC(=C(C=C3)OC)OC
InChI=1SC22H24ClN5O5Sc12819(112421(30)135717(323)18(913)334)262722(28)341220(29)25151014(23)6816(15)312h510H1112H214H3(H2430)(H2529)
MFCD04127775
N((5((2((5CHLORO2METHOXYPHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)METHYL)34DIMETHOXYBENZAMIDE
N((5(2(5CHLORO2METHOXYANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)METHYL)34DIMETHOXYBENZAMIDE
ZINC000001122181
ZINC01122181
ZINC1122181
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