Vitas-M small molecule compound
2-{[5-(3,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenylethanone
Catalog ID
STK807606
SMILES COc1ccc(cc1)n1c(SCC(=O)c2ccccc2)nnc1c1ccc(c(c1)OC)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 C25H23N3O4S MW 461.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O4S/c1-30-20-12-10-19(11-13-20)28-24(18-9-14-22(31-2)23(15-18)32-3)26-27-25(28)33-16-21(29)17-7-5-4-6-8-17/h4-15H,16H2,1-3H3InChIKey
IIMULAFICTXGKE-UHFFFAOYSA-NSynonyms
2((5(34DIMETHOXYPHENYL)4(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)1PHENYLETHANONE
2((5(34dimethoxyphenyl)4(4methoxyphenyl)4H124triazol3yl)sulfanyl)1phenylethanone
2(5(34DIMETHOXYPHENYL)4(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))1PHENYLETHAN1ONE
COC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=CC=CC=C3)C4=CC(=C(C=C4)OC)OC
InChI=1SC25H23N3O4Sc13020121019(111320)2824(1891422(312)23(1518)323)262725(28)331621(29)177546817h415H16H213H3
MFCD04445574
ZINC000015441351
ZINC15441351
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