Vitas-M small molecule compound
3-benzyl-6-chloro-4-methyl-2-oxo-2H-chromen-7-yl 2-[(tert-butoxycarbonyl)amino]butanoate
Catalog ID
STL226640
SMILES CCC(C(=O)Oc1cc2oc(=O)c(c(c2cc1Cl)C)Cc1ccccc1)NC(=O)OC(C)(C)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 C26H28ClNO6 MW 485.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28ClNO6/c1-6-20(28-25(31)34-26(3,4)5)24(30)33-22-14-21-17(13-19(22)27)15(2)18(23(29)32-21)12-16-10-8-7-9-11-16/h7-11,13-14,20H,6,12H2,1-5H3,(H,28,31)InChIKey
UCOVGEVSPDWPER-UHFFFAOYSA-NSynonyms
1043016-49-4(3BENZYL6CHLORO4METHYL2OXOCHROMEN7YL)2((2METHYLPROPAN2YL)OXYCARBONYLAMINO)BUTANOATE
1043016494
3benzyl6chloro4methyl2oxo2Hchromen7yl2((tertbutoxycarbonyl)amino)butanoate
CCC(C(=O)OC1=C(C=C2C(=C(C(=O)OC2=C1)CC3=CC=CC=C3)C)Cl)NC(=O)OC(C)(C)C
InChI=1SC26H28ClNO6c1620(2825(31)3426(34)5)24(30)3322142117(1319(22)27)15(2)18(23(29)3221)1216108791116h711131420H612H215H3(H2831)
MFCD04007701
ZINC000002265069
ZINC000002265070
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