Vitas-M small molecule compound

methyl 2-{[(2E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino}-4,5-dimethylthiophene-3-carboxylate

Catalog ID
STK418658
SMILES COC(=O)c1c(NC(=O)/C=C/c2ccc(c(c2)OC)OC)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 C19H21NO5S MW 375.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21NO5S/c1-11-12(2)26-18(17(11)19(22)25-5)20-16(21)9-7-13-6-8-14(23-3)15(10-13)24-4/h6-10H,1-5H3,(H,20,21)/b9-7+
InChIKey
OJQNRLXTJCVKMC-VQHVLOKHSA-N
Synonyms
354994-70-0
(E)methyl2(3(34dimethoxyphenyl)acrylamido)45dimethylthiophene3carboxylate
354994700
CC1=C(SC(=C1C(=O)OC)NC(=O)C=CC2=CC(=C(C=C2)OC)OC)C
COC(=O)c1c(NC(=O)C=Cc2ccc(c(c2)OC)OC)sc(c1C)C
InChI=1SC19H21NO5Sc11112(2)2618(17(11)19(22)255)2016(21)97136814(233)15(1013)244h610H15H3(H2021)b97+
methyl2(((2E)3(34dimethoxyphenyl)prop2enoyl)amino)45dimethylthiophene3carboxylate
METHYL2(((E)3(34DIMETHOXYPHENYL)PROP2ENOYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
METHYL2((3(34DIMETHOXYPHENYL)ACRYLOYL)AMINO)45DIMETHYL3THIOPHENECARBOXYLATE
MFCD01349445
ZINC000000995860
ZINC00995860
ZINC995860

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Available files

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