Vitas-M small molecule compound
2-{[4-(furan-2-ylmethyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Catalog ID
STL347466
SMILES O=C(Nc1cccc(c1)C)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 C21H19N5O2S MW 405.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N5O2S/c1-15-4-2-5-17(12-15)23-19(27)14-29-21-25-24-20(16-7-9-22-10-8-16)26(21)13-18-6-3-11-28-18/h2-12H,13-14H2,1H3,(H,23,27)InChIKey
LWZXWTOAQMSACQ-UHFFFAOYSA-NSynonyms
333408-98-32((4(furan2ylmethyl)5(pyridin4yl)4H124triazol3yl)sulfanyl)N(3methylphenyl)acetamide
2((4(furan2ylmethyl)5(pyridin4yl)4H124triazol3yl)thio)N(mtolyl)acetamide
2((4(FURAN2YLMETHYL)5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)N(3METHYLPHENYL)ACETAMIDE
2(4(2FURYLMETHYL)5(4PYRIDYL)(124TRIAZOL3YLTHIO))N(3METHYLPHENYL)ACETAMIDE
333408983
CC1=CC(=CC=C1)NC(=O)CSC2=NN=C(N2CC3=CC=CO3)C4=CC=NC=C4
InChI=1SC21H19N5O2Sc11542517(1215)2319(27)142921252420(16792210816)26(21)131863112818h212H1314H21H3(H2327)
MFCD02232344
ZINC000000873109
ZINC00873109
ZINC873109
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