Vitas-M small molecule compound

4-({4-(2,5-dimethylphenyl)-3-[(propan-2-yloxy)carbonyl]thiophen-2-yl}amino)-4-oxobutanoic acid

Catalog ID
STK471842
SMILES CC(OC(=O)c1c(scc1c1cc(C)ccc1C)NC(=O)CCC(=O)O)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 C20H23NO5S MW 389.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23NO5S/c1-11(2)26-20(25)18-15(14-9-12(3)5-6-13(14)4)10-27-19(18)21-16(22)7-8-17(23)24/h5-6,9-11H,7-8H2,1-4H3,(H,21,22)(H,23,24)
InChIKey
RYEANLDTYDYUCA-UHFFFAOYSA-N
Synonyms

3(N(4(25DIMETHYLPHENYL)3((METHYLETHYL)OXYCARBONYL)2THIENYL)CARBAMOYL)PROPANOICACID
4((4(25dimethylphenyl)3((propan2yloxy)carbonyl)thiophen2yl)amino)4oxobutanoicacid
4((4(25dimethylphenyl)3propan2yloxycarbonylthiophen2yl)amino)4oxobutanoicacid
CC1=CC(=C(C=C1)C)C2=CSC(=C2C(=O)OC(C)C)NC(=O)CCC(=O)O
InChI=1SC20H23NO5Sc111(2)2620(25)1815(14912(3)5613(14)4)102719(18)2116(22)7817(23)24h56911H78H214H3(H2122)(H2324)
MFCD02255072
ZINC000006189969
ZINC6189969

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Available files

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