Vitas-M small molecule compound
{[5-(3,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid
Catalog ID
STK807609
SMILES COc1ccc(cc1)n1c(SCC(=O)O)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 C19H19N3O5S MW 401.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O5S/c1-25-14-7-5-13(6-8-14)22-18(20-21-19(22)28-11-17(23)24)12-4-9-15(26-2)16(10-12)27-3/h4-10H,11H2,1-3H3,(H,23,24)InChIKey
SWSOKSIKEZMXHU-UHFFFAOYSA-NSynonyms
((5(34dimethoxyphenyl)4(4methoxyphenyl)4H124triazol3yl)sulfanyl)aceticacid
2((5(34DIMETHOXYPHENYL)4(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)ACETICACID
2(5(34DIMETHOXYPHENYL)4(4METHOXYPHENYL)124TRIAZOL3YLTHIO)ACETICACID
COC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)O)C3=CC(=C(C=C3)OC)OC
InChI=1SC19H19N3O5Sc125147513(6814)2218(202119(22)281117(23)24)124915(262)16(1012)273h410H11H213H3(H2324)
MFCD04445577
ZINC000002700586
ZINC2700586
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