Vitas-M small molecule compound

propan-2-yl 5-methyl-4-(4-methylphenyl)-2-{[(2-oxo-2H-chromen-3-yl)carbonyl]amino}thiophene-3-carboxylate

Catalog ID
STK450979
SMILES CC(OC(=O)c1c(NC(=O)c2cc3ccccc3oc2=O)sc(c1c1ccc(cc1)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 C26H23NO5S MW 461.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23NO5S/c1-14(2)31-26(30)22-21(17-11-9-15(3)10-12-17)16(4)33-24(22)27-23(28)19-13-18-7-5-6-8-20(18)32-25(19)29/h5-14H,1-4H3,(H,27,28)
InChIKey
AHBNSNYBMAXJFY-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC(C)C)NC(=O)C3=CC4=CC=CC=C4OC3=O)C
InChI=1SC26H23NO5Sc114(2)3126(30)2221(1711915(3)101217)16(4)3324(22)2723(28)191318756820(18)3225(19)29h514H14H3(H2728)
ISOPROPYL5METHYL4(4METHYLPHENYL)2(((2OXO2HCHROMEN3YL)CARBONYL)AMINO)3THIOPHENECARBOXYLATE
METHYLETHYL5METHYL4(4METHYLPHENYL)2((2OXOCHROMEN3YL)CARBONYLAMINO)THIOPHENE3CARBOXYLATE
MFCD03071039
propan2yl5methyl4(4methylphenyl)2(((2oxo2Hchromen3yl)carbonyl)amino)thiophene3carboxylate
PROPAN2YL5METHYL4(4METHYLPHENYL)2((2OXOCHROMENE3CARBONYL)AMINO)THIOPHENE3CARBOXYLATE
ZINC000002089876
ZINC02089876
ZINC2089876

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.