Vitas-M small molecule compound
N-(6-acetyl-1,3-benzodioxol-5-yl)-4-(1,3-dioxodihydro-1H,5H-pyrazolo[1,2-a][1,2,4]triazol-2(3H)-yl)benzenesulfonamide
Catalog ID
STK737526
SMILES CC(=O)c1cc2OCOc2cc1NS(=O)(=O)c1ccc(cc1)n1c(=O)n2n(c1=O)CCC2
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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 C20H18N4O7S MW 458.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O7S/c1-12(25)15-9-17-18(31-11-30-17)10-16(15)21-32(28,29)14-5-3-13(4-6-14)24-19(26)22-7-2-8-23(22)20(24)27/h3-6,9-10,21H,2,7-8,11H2,1H3InChIKey
FVMSENRMSZXDKE-UHFFFAOYSA-NSynonyms
CC(=O)C1=CC2=C(C=C1NS(=O)(=O)C3=CC=C(C=C3)N4C(=O)N5CCCN5C4=O)OCO2
InChI=1SC20H18N4O7Sc112(25)1591718(31113017)1016(15)2132(2829)145313(4614)2419(26)2272823(22)20(24)27h3691021H27811H21H3
MFCD07022593
N(6ACETYL13BENZODIOXOL5YL)4(13DIOXO67DIHYDRO5HPYRAZOLO(12A)(124)TRIAZOL2YL)BENZENESULFONAMIDE
N(6acetyl13benzodioxol5yl)4(13dioxodihydro1H5Hpyrazolo(12a)(124)triazol2(3H)yl)benzenesulfonamide
ZINC000012364703
ZINC12364703
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