Vitas-M small molecule compound
N-[3-(2-methoxyphenyl)-1H-1,2,4-triazol-5-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Catalog ID
STL318276
SMILES COc1ccccc1c1n[nH]c(n1)NC(=O)c1ccc2c(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 C19H18N4O4 MW 366.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4O4/c1-25-14-6-3-2-5-13(14)17-20-19(23-22-17)21-18(24)12-7-8-15-16(11-12)27-10-4-9-26-15/h2-3,5-8,11H,4,9-10H2,1H3,(H2,20,21,22,23,24)InChIKey
ZGLKKFWDNMXLNO-UHFFFAOYSA-NSynonyms
1574495-99-01574495990
COC1=CC=CC=C1C2=NC(=NN2)NC(=O)C3=CC4=C(C=C3)OCCCO4
COc1ccccc1c1(nH)nc(n1)NC(=O)c1ccc2c(c1)OCCCO2
COc1ccccc1c1n(nH)c(n1)NC(=O)c1ccc2c(c1)OCCCO2
InChI=1SC19H18N4O4c12514632513(14)172019(232217)2118(24)12781516(1112)2710492615h235811H4910H21H3(H22021222324)
MFCD28031196
N(3(2methoxyphenyl)1H124triazol5yl)34dihydro2H15benzodioxepine7carboxamide
N(5(2methoxyphenyl)1H124triazol3yl)34dihydro2H15benzodioxepine7carboxamide
N(5(2methoxyphenyl)1H124triazol3yl)34dihydro2Hbenzo(b)(14)dioxepine7carboxamide
ZINC000048011996
ZINC48011996
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