Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-2-({5-[(2-ethoxy-4-methylphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)propanamide
Catalog ID
STK222045
SMILES CCOc1cc(C)ccc1OCc1nnc(n1C)SC(C(=O)Nc1ccc2c(c1)OCO2)C
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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 C23H26N4O5S MW 470.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O5S/c1-5-29-19-10-14(2)6-8-17(19)30-12-21-25-26-23(27(21)4)33-15(3)22(28)24-16-7-9-18-20(11-16)32-13-31-18/h6-11,15H,5,12-13H2,1-4H3,(H,24,28)InChIKey
CMJNZQIDAQICIA-UHFFFAOYSA-NSynonyms
CCOC1=C(C=CC(=C1)C)OCC2=NN=C(N2C)SC(C)C(=O)NC3=CC4=C(C=C3)OCO4
InChI=1SC23H26N4O5Sc1529191014(2)6817(19)301221252623(27(21)4)3315(3)22(28)2416791820(1116)32133118h61115H51213H214H3(H2428)
MFCD07401485
N(13BENZODIOXOL5YL)2((5((2ETHOXY4METHYLPHENOXY)METHYL)4METHYL124TRIAZOL3YL)SULFANYL)PROPANAMIDE
N(13benzodioxol5yl)2((5((2ethoxy4methylphenoxy)methyl)4methyl4H124triazol3yl)sulfanyl)propanamide
ZINC000009303621
ZINC000009303624
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