Vitas-M small molecule compound

(2Z)-6-hydroxy-7-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-2-[(5-methoxy-1-methyl-1H-indol-3-yl)methylidene]-1-benzofuran-3(2H)-one

Catalog ID
STK992764
SMILES OCCN1CCN(CC1)Cc1c(O)ccc2c1O/C(=C\c1cn(c3c1cc(OC)cc3)C)/C2=O

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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 C26H29N3O5 MW 463.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O5/c1-27-15-17(20-14-18(33-2)3-5-22(20)27)13-24-25(32)19-4-6-23(31)21(26(19)34-24)16-29-9-7-28(8-10-29)11-12-30/h3-6,13-15,30-31H,7-12,16H2,1-2H3/b24-13-
InChIKey
JYEFICSZCAMMRS-CFRMEGHHSA-N
Synonyms

(2Z)6hydroxy7((4(2hydroxyethyl)piperazin1yl)methyl)2((5methoxy1methyl1Hindol3yl)methylidene)1benzofuran3(2H)one
(2Z)6hydroxy7((4(2hydroxyethyl)piperazin1yl)methyl)2((5methoxy1methylindol3yl)methylidene)1benzofuran3one
(E)6hydroxy7((4(2hydroxyethyl)piperazin1yl)methyl)2((5methoxy1methyl1Hindol3yl)methylene)benzofuran3(2H)one
6HYDROXY7((4(2HYDROXYETHYL)PIPERAZINYL)METHYL)2((5METHOXY1METHYLINDOL3YL)METHYLENE)BENZO(B)FURAN3ONE
CN1C=C(C2=C1C=CC(=C2)OC)C=C3C(=O)C4=C(O3)C(=C(C=C4)O)CN5CCN(CC5)CCO
InChI=1SC26H29N3O5c1271517(201418(332)3522(20)27)132425(32)194623(31)21(26(19)3424)16299728(81029)111230h3613153031H71216H212H3b2413
MFCD18184623
OCCN1CCN(CC1)Cc1c(O)ccc2c1OC(=Cc1cn(c3c1cc(OC)cc3)C)C2=O
ZINC000028182447
ZINC28182447

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Available files

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