Vitas-M small molecule compound
N-(2-{6-[(1E)-3-(6-hydroxy-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-3-oxoprop-1-en-1-yl]-7-methoxy-1,3-benzodioxol-5-yl}ethyl)-N-methylbenzamide
Catalog ID
STL520794
SMILES COc1c(/C=C/C(=O)c2c(O)n(C)c(=O)n(c2=O)C)c(CCN(C(=O)c2ccccc2)C)cc2c1OCO2
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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 C27H27N3O8 MW 521.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O8/c1-28(24(32)16-8-6-5-7-9-16)13-12-17-14-20-23(38-15-37-20)22(36-4)18(17)10-11-19(31)21-25(33)29(2)27(35)30(3)26(21)34/h5-11,14,33H,12-13,15H2,1-4H3/b11-10+InChIKey
PKSFWNFYRFQSQU-ZHACJKMWSA-NSynonyms
1173503-56-4(E)N(2(6(3(6hydroxy13dimethyl24dioxo1234tetrahydropyrimidin5yl)3oxoprop1en1yl)7methoxybenzo(d)(13)dioxol5yl)ethyl)Nmethylbenzamide
~(N)(2(6((~(E))3(4hydroxy13dimethyl26dioxopyrimidin5yl)3oxoprop1enyl)7methoxy13benzodioxol5yl)ethyl)~(N)methylbenzamide
1173503564
5908460
COc1c(C=CC(=O)c2c(O)n(C)c(=O)n(c2=O)C)c(CCN(C(=O)c2ccccc2)C)cc2c1OCO2
InChI=1SC27H27N3O8c128(24(32)168657916)131217142023(38153720)22(364)18(17)101119(31)2125(33)29(2)27(35)30(3)26(21)34h5111433H121315H214H3b1110+
MFCD04146754
N(2(6((1E)3(6hydroxy13dimethyl24dioxo1234tetrahydropyrimidin5yl)3oxoprop1en1yl)7methoxy13benzodioxol5yl)ethyl)Nmethylbenzamide
N(2(6((E)3(4HYDROXY13DIMETHYL26DIOXOPYRIMIDIN5YL)3OXOPROP1ENYL)7METHOXY13BENZODIOXOL5YL)ETHYL)NMETHYLBENZAMIDE
ZINC000008917985
ZINC8917985
Check stock
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Check stock on Vitas-MAvailable files
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