Vitas-M small molecule compound
2-{[4-(furan-2-ylmethyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
Catalog ID
STL340957
SMILES COc1cccc(c1)NC(=O)CSc1nnc(n1Cc1ccco1)c1ccncc1
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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 C21H19N5O3S MW 421.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N5O3S/c1-28-17-5-2-4-16(12-17)23-19(27)14-30-21-25-24-20(15-7-9-22-10-8-15)26(21)13-18-6-3-11-29-18/h2-12H,13-14H2,1H3,(H,23,27)InChIKey
OUODOMSZESHTGL-UHFFFAOYSA-NSynonyms
578003-12-02((4(furan2ylmethyl)5(pyridin4yl)4H124triazol3yl)sulfanyl)N(3methoxyphenyl)acetamide
2((4(furan2ylmethyl)5(pyridin4yl)4H124triazol3yl)thio)N(3methoxyphenyl)acetamide
2((4(FURAN2YLMETHYL)5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)N(3METHOXYPHENYL)ACETAMIDE
2(4(2FURYLMETHYL)5(4PYRIDYL)(124TRIAZOL3YLTHIO))N(3METHOXYPHENYL)ACETAMIDE
578003120
COC1=CC=CC(=C1)NC(=O)CSC2=NN=C(N2CC3=CC=CO3)C4=CC=NC=C4
InChI=1SC21H19N5O3Sc1281752416(1217)2319(27)143021252420(15792210815)26(21)131863112918h212H1314H21H3(H2327)
MFCD04023645
ZINC000002369313
ZINC02369313
ZINC2369313
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