Vitas-M small molecule compound
2-{[5-(1,3-benzodioxol-5-yl)-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK474165
SMILES NC(=O)CSc1nnc(n1CC1CCCO1)c1ccc2c(c1)OCO2
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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 C16H18N4O4S MW 362.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4O4S/c17-14(21)8-25-16-19-18-15(20(16)7-11-2-1-5-22-11)10-3-4-12-13(6-10)24-9-23-12/h3-4,6,11H,1-2,5,7-9H2,(H2,17,21)InChIKey
VHTWKYFZESMKIP-UHFFFAOYSA-NSynonyms
2((5(13benzodioxol5yl)4(oxolan2ylmethyl)124triazol3yl)sulfanyl)acetamide
2((5(13benzodioxol5yl)4(tetrahydrofuran2ylmethyl)4H124triazol3yl)sulfanyl)acetamide
2(5(2HBENZO(34D)13DIOXOLEN5YL)4(OXOLAN2YLMETHYL)124TRIAZOL3YLTHIO)ACETAMIDE
C1CC(OC1)CN2C(=NN=C2SCC(=O)N)C3=CC4=C(C=C3)OCO4
InChI=1SC16H18N4O4Sc1714(21)82516191815(20(16)7112152211)10341213(610)2492312h34611H12579H2(H21721)
MFCD07612757
ZINC000017074536
ZINC000017074537
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