Vitas-M small molecule compound

methyl 4,5-dimethyl-2-{[(1-oxo-1H-isochromen-3-yl)carbonyl]amino}thiophene-3-carboxylate

Catalog ID
STK853522
SMILES COC(=O)c1c(NC(=O)c2cc3ccccc3c(=O)o2)sc(c1C)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 C18H15NO5S MW 357.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15NO5S/c1-9-10(2)25-16(14(9)18(22)23-3)19-15(20)13-8-11-6-4-5-7-12(11)17(21)24-13/h4-8H,1-3H3,(H,19,20)
InChIKey
ZGTUCXMKWSQPLZ-UHFFFAOYSA-N
Synonyms
438615-86-2
438615862
CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC3=CC=CC=C3C(=O)O2)C
InChI=1SC18H15NO5Sc1910(2)2516(14(9)18(22)233)1915(20)13811645712(11)17(21)2413h48H13H3(H1920)
methyl45dimethyl2(((1oxo1Hisochromen3yl)carbonyl)amino)thiophene3carboxylate
METHYL45DIMETHYL2((1OXOISOCHROMENE3CARBONYL)AMINO)THIOPHENE3CARBOXYLATE
methyl45dimethyl2(1oxo1Hisochromene3carboxamido)thiophene3carboxylate
MFCD02605416
ZINC000002486562
ZINC02486562
ZINC2486562

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Available files

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