Vitas-M small molecule compound

(2Z)-2-[4-(methoxycarbonyl)benzylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 5-ethoxy-2-phenyl-1-benzofuran-3-carboxylate

Catalog ID
STK923817
SMILES CCOc1ccc2c(c1)c(C(=O)Oc1ccc3c(c1)O/C(=C\c1ccc(cc1)C(=O)OC)/C3=O)c(o2)c1ccccc1

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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 C34H24O8 MW 560.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H24O8/c1-3-39-23-14-16-27-26(18-23)30(32(42-27)21-7-5-4-6-8-21)34(37)40-24-13-15-25-28(19-24)41-29(31(25)35)17-20-9-11-22(12-10-20)33(36)38-2/h4-19H,3H2,1-2H3/b29-17-
InChIKey
BPIFYCSNHXAZFZ-RHANQZHGSA-N
Synonyms
858766-79-7
((2Z)2((4METHOXYCARBONYLPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)5ETHOXY2PHENYL1BENZOFURAN3CARBOXYLATE
(2Z)2(4(methoxycarbonyl)benzylidene)3oxo23dihydro1benzofuran6yl5ethoxy2phenyl1benzofuran3carboxylate
(Z)2(4(methoxycarbonyl)benzylidene)3oxo23dihydrobenzofuran6yl5ethoxy2phenylbenzofuran3carboxylate
2((4(METHOXYCARBONYL)PHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL5ETHOXY2PHENYLBENZO(B)FURAN3CARBOXYLATE
858766797
CCOC1=CC2=C(C=C1)OC(=C2C(=O)OC3=CC4=C(C=C3)C(=O)C(=CC5=CC=C(C=C5)C(=O)OC)O4)C6=CC=CC=C6
CCOc1ccc2c(c1)c(C(=O)Oc1ccc3c(c1)OC(=Cc1ccc(cc1)C(=O)OC)C3=O)c(o2)c1ccccc1
InChI=1SC34H24O8c13392314162726(1823)30(32(4227)217546821)34(37)402413152528(1924)4129(31(25)35)172091122(121020)33(36)382h419H3H212H3b2917
MFCD04144933
ZINC000070686670
ZINC70686670

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Available files

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