Vitas-M small molecule compound
N-(1,3-benzodioxol-5-ylcarbonyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1,3-benzodioxole-5-carboxamide
Catalog ID
STK442986
SMILES O=C(N(c1c(C)n(n(c1=O)c1ccccc1)C)C(=O)c1ccc2c(c1)OCO2)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 C27H21N3O7 MW 499.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21N3O7/c1-16-24(27(33)30(28(16)2)19-6-4-3-5-7-19)29(25(31)17-8-10-20-22(12-17)36-14-34-20)26(32)18-9-11-21-23(13-18)37-15-35-21/h3-13H,14-15H2,1-2H3InChIKey
GSIVYVJEJXAJRB-UHFFFAOYSA-NSynonyms
2HBENZO(34D)13DIOXOLAN5YLN(2HBENZO(34D)13DIOXOLAN5YLCARBONYL)N(23DIMETHYL5OXO1PHENYL(3PYRAZOLIN4YL))CARBOXAMIDE
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C(=O)C3=CC4=C(C=C3)OCO4)C(=O)C5=CC6=C(C=C5)OCO6
InChI=1SC27H21N3O7c11624(27(33)30(28(16)2)196435719)29(25(31)178102022(1217)36143420)26(32)189112123(1318)37153521h313H1415H212H3
MFCD04054520
N(13benzodioxol5ylcarbonyl)N(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)13benzodioxole5carboxamide
N(13benzodioxole5carbonyl)N(15dimethyl3oxo2phenylpyrazol4yl)13benzodioxole5carboxamide
ZINC000020293746
ZINC20293746
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