Vitas-M small molecule compound
2-{[5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(pyrrolidin-1-yl)ethanone
Catalog ID
STL364382
SMILES COc1ccc(cc1)c1nnc(n1C)SCC(=O)N1CCCC1
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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 C16H20N4O2S MW 332.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N4O2S/c1-19-15(12-5-7-13(22-2)8-6-12)17-18-16(19)23-11-14(21)20-9-3-4-10-20/h5-8H,3-4,9-11H2,1-2H3InChIKey
WJPPUOMROQNTMQ-UHFFFAOYSA-NSynonyms
2((5(4METHOXYPHENYL)4METHYL124TRIAZOL3YL)SULFANYL)1PYRROLIDIN1YLETHANONE
2((5(4methoxyphenyl)4methyl4H124triazol3yl)sulfanyl)1(pyrrolidin1yl)ethanone
CN1C(=NN=C1SCC(=O)N2CCCC2)C3=CC=C(C=C3)OC
InChI=1SC16H20N4O2Sc11915(125713(222)8612)171816(19)231114(21)209341020h58H34911H212H3
MFCD02750012
ZINC000000418124
ZINC00418124
ZINC418124
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