Vitas-M small molecule compound

4-({(2E)-2-[(phenylcarbonyl)amino]-3-[4-(propan-2-yloxy)phenyl]prop-2-enoyl}amino)butanoic acid

Catalog ID
STL512700
SMILES CC(Oc1ccc(cc1)/C=C(\C(=O)NCCCC(=O)O)/NC(=O)c1ccccc1)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 C23H26N2O5 MW 410.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N2O5/c1-16(2)30-19-12-10-17(11-13-19)15-20(23(29)24-14-6-9-21(26)27)25-22(28)18-7-4-3-5-8-18/h3-5,7-8,10-13,15-16H,6,9,14H2,1-2H3,(H,24,29)(H,25,28)(H,26,27)/b20-15+
InChIKey
YWJNOOUVWKDHDT-HMMYKYKNSA-N
Synonyms
331259-48-4
(E)4(2benzamido3(4isopropoxyphenyl)acrylamido)butanoicacid
331259484
4(((~(E))2benzamido3(4propan2yloxyphenyl)prop2enoyl)amino)butanoicacid
4(((2E)2((phenylcarbonyl)amino)3(4(propan2yloxy)phenyl)prop2enoyl)amino)butanoicacid
4(((E)2BENZAMIDO3(4PROPAN2YLOXYPHENYL)PROP2ENOYL)AMINO)BUTANOICACID
4(2BENZOYLAMINO3(4ISOPROPOXYPHENYL)ACRYLOYLAMINO)BUTYRICACID
5754409
CC(Oc1ccc(cc1)C=C(C(=O)NCCCC(=O)O)NC(=O)c1ccccc1)C
InChI=1SC23H26N2O5c116(2)3019121017(111319)1520(23(29)24146921(26)27)2522(28)187435818h357810131516H6914H212H3(H2429)(H2528)(H2627)b2015+
MFCD00610596
ZINC000012652797
ZINC12652797

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Available files

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