Vitas-M small molecule compound
1-tert-butyl 2-[6-butyl-3-(2-methyl-1,3-thiazol-4-yl)-4-oxo-4H-chromen-7-yl] (2S)-pyrrolidine-1,2-dicarboxylate
Catalog ID
STL303580
SMILES CCCCc1cc2c(cc1OC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C)occ(c2=O)c1csc(n1)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 C27H32N2O6S MW 512.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N2O6S/c1-6-7-9-17-12-18-23(33-14-19(24(18)30)20-15-36-16(2)28-20)13-22(17)34-25(31)21-10-8-11-29(21)26(32)35-27(3,4)5/h12-15,21H,6-11H2,1-5H3/t21-/m0/s1InChIKey
IERZMJZTEHTAAV-NRFANRHFSA-NSynonyms
(R)1tertbutyl2(6butyl3(2methylthiazol4yl)4oxo4Hchromen7yl)pyrrolidine12dicarboxylate
1Otertbutyl2O(6butyl3(2methyl13thiazol4yl)4oxochromen7yl)(2S)pyrrolidine12dicarboxylate
1tertbutyl2(6butyl3(2methyl13thiazol4yl)4oxo4Hchromen7yl)(2S)pyrrolidine12dicarboxylate
CCCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CSC(=N3)C)OC(=O)C4CCCN4C(=O)OC(C)(C)C
CCCCc1cc2c(cc1OC(=O)(C@@H)1CCCN1C(=O)OC(C)(C)C)occ(c2=O)c1csc(n1)C
CCCCc1cc2c(cc1OC(=O)(C@H)1CCCN1C(=O)OC(C)(C)C)occ(c2=O)c1csc(n1)C
InChI=1SC27H32N2O6Sc167917121823(331419(24(18)30)20153616(2)2820)1322(17)3425(31)211081129(21)26(32)3527(34)5h121521H611H215H3t21m0s1
ZINC000011865724
ZINC11865724
Check stock
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Check stock on Vitas-MAvailable files
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