Vitas-M small molecule compound
N-cyclopentyl-2-{[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK257178
SMILES O=C(NC1CCCC1)CSc1nnc(n1C)c1ccc2c(c1)OCCO2
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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 C18H22N4O3S MW 374.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N4O3S/c1-22-17(12-6-7-14-15(10-12)25-9-8-24-14)20-21-18(22)26-11-16(23)19-13-4-2-3-5-13/h6-7,10,13H,2-5,8-9,11H2,1H3,(H,19,23)InChIKey
JDJBGKKTFSEHJC-UHFFFAOYSA-NSynonyms
CN1C(=NN=C1SCC(=O)NC2CCCC2)C3=CC4=C(C=C3)OCCO4
InChI=1SC18H22N4O3Sc12217(12671415(1012)25982414)202118(22)261116(23)1913423513h671013H258911H21H3(H1923)
MFCD08672373
Ncyclopentyl2((5(23dihydro14benzodioxin6yl)4methyl124triazol3yl)sulfanyl)acetamide
NCYCLOPENTYL2((5(23DIHYDRO14BENZODIOXIN6YL)4METHYL4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000009356038
ZINC09356038
ZINC9356038
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