Vitas-M small molecule compound
2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[3-(tetrahydrofuran-2-yl)-1H-1,2,4-triazol-5-yl]acetamide
Catalog ID
STL312844
SMILES O=C(Nc1[nH]nc(n1)C1CCCO1)Cc1ccc2c(c1)OCCCO2
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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 C17H20N4O4 MW 344.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N4O4/c22-15(18-17-19-16(20-21-17)13-3-1-6-24-13)10-11-4-5-12-14(9-11)25-8-2-7-23-12/h4-5,9,13H,1-3,6-8,10H2,(H2,18,19,20,21,22)InChIKey
ZODBAZQQKUQIDY-UHFFFAOYSA-NSynonyms
1574336-56-31574336563
2(34dihydro2H15benzodioxepin7yl)N(3(tetrahydrofuran2yl)1H124triazol5yl)acetamide
2(34dihydro2H15benzodioxepin7yl)N(5(oxolan2yl)1H124triazol3yl)acetamide
2(34dihydro2Hbenzo(b)(14)dioxepin7yl)N(5(tetrahydrofuran2yl)1H124triazol3yl)acetamide
C1CC(OC1)C2=NC(=NN2)NC(=O)CC3=CC4=C(C=C3)OCCCO4
InChI=1SC17H20N4O4c2215(18171916(202117)133162413)1011451214(911)258272312h45913H136810H2(H21819202122)
MFCD28029763
O=C(Nc1(nH)nc(n1)C1CCCO1)Cc1ccc2c(c1)OCCCO2
O=C(Nc1n(nH)c(n1)C1CCCO1)Cc1ccc2c(c1)OCCCO2
ZINC000095475083
ZINC000095475084
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