Vitas-M small molecule compound
N-[2-(7,8-dimethyl-2-oxo-2H-chromen-4-yl)-1-benzofuran-3-yl]-1,3-benzodioxole-5-carboxamide
Catalog ID
STL034715
SMILES O=c1cc(c2oc3c(c2NC(=O)c2ccc4c(c2)OCO4)cccc3)c2c(o1)c(C)c(cc2)C
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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 C27H19NO6 MW 453.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19NO6/c1-14-7-9-17-19(12-23(29)34-25(17)15(14)2)26-24(18-5-3-4-6-20(18)33-26)28-27(30)16-8-10-21-22(11-16)32-13-31-21/h3-12H,13H2,1-2H3,(H,28,30)InChIKey
BXVQBFMECKITQS-UHFFFAOYSA-NSynonyms
919723-32-32HBENZO(34D)13DIOXOLAN5YLN(2(78DIMETHYL2OXOCHROMEN4YL)BENZO(B)FURAN3YL)CARBOXAMIDE
919723323
CC1=C(C2=C(C=C1)C(=CC(=O)O2)C3=C(C4=CC=CC=C4O3)NC(=O)C5=CC6=C(C=C5)OCO6)C
InChI=1SC27H19NO6c114791719(1223(29)3425(17)15(14)2)2624(18534620(18)3326)2827(30)168102122(1116)32133121h312H13H212H3(H2830)
MFCD08742518
N(2(78dimethyl2oxo2Hchromen4yl)1benzofuran3yl)13benzodioxole5carboxamide
N(2(78dimethyl2oxo2Hchromen4yl)benzofuran3yl)benzo(d)(13)dioxole5carboxamide
N(2(78dimethyl2oxochromen4yl)1benzofuran3yl)13benzodioxole5carboxamide
ZINC000012894966
ZINC12894966
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