Vitas-M small molecule compound
methyl 4-{(Z)-[9-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-3,7-dioxo-8,9-dihydro-7H-furo[2,3-f]chromen-2(3H)-ylidene]methyl}benzoate
Catalog ID
STL546652
SMILES COC(=O)c1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc1c2C(CC(=O)O1)c1ccc2c(c1)n(C)c(=O)n2C
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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 C29H22N2O7 MW 510.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22N2O7/c1-30-20-10-8-17(13-21(20)31(2)29(30)35)19-14-24(32)37-22-11-9-18-26(33)23(38-27(18)25(19)22)12-15-4-6-16(7-5-15)28(34)36-3/h4-13,19H,14H2,1-3H3/b23-12-InChIKey
AEBKDQAETKEGRC-FMCGGJTJSA-NSynonyms
(Z)methyl4((9(13dimethyl2oxo23dihydro1Hbenzo(d)imidazol5yl)37dioxo3789tetrahydro2Hfuro(23f)chromen2ylidene)methyl)benzoate
121541048
COC(=O)c1ccc(cc1)C=C1Oc2c(C1=O)ccc1c2C(CC(=O)O1)c1ccc2c(c1)n(C)c(=O)n2C
InChI=1SC29H22N2O7c1302010817(1321(20)31(2)29(30)35)191424(32)37221191826(33)23(3827(18)25(19)22)12154616(7515)28(34)363h41319H14H213H3b2312
methyl4((~(Z))(9(13dimethyl2oxobenzimidazol5yl)37dioxo89dihydrofuro(23f)chromen2ylidene)methyl)benzoate
methyl4((Z)(9(13dimethyl2oxo23dihydro1Hbenzimidazol5yl)37dioxo89dihydro7Hfuro(23f)chromen2(3H)ylidene)methyl)benzoate
MFCD30344002
ZINC000263584751
ZINC001081801608
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