Vitas-M small molecule compound

ethyl 5-acetyl-2-({[(2E)-2-(2,3-dimethoxybenzylidene)hydrazinyl]carbonyl}amino)-4-methylthiophene-3-carboxylate

Catalog ID
STL331466
SMILES CCOC(=O)c1c(NC(=O)N/N=C/c2cccc(c2OC)OC)sc(c1C)C(=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 C20H23N3O6S MW 433.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O6S/c1-6-29-19(25)15-11(2)17(12(3)24)30-18(15)22-20(26)23-21-10-13-8-7-9-14(27-4)16(13)28-5/h7-10H,6H2,1-5H3,(H2,22,23,26)/b21-10+
InChIKey
JNLXLJNKNWEHQG-UFFVCSGVSA-N
Synonyms
301682-21-3
(E)ethyl5acetyl2(2(23dimethoxybenzylidene)hydrazinecarboxamido)4methylthiophene3carboxylate
301682213
CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)NN=CC2=C(C(=CC=C2)OC)OC
CCOC(=O)c1c(NC(=O)NN=Cc2cccc(c2OC)OC)sc(c1C)C(=O)C
ethyl5acetyl2((((2E)2(23dimethoxybenzylidene)hydrazinyl)carbonyl)amino)4methylthiophene3carboxylate
ETHYL5ACETYL2(((E)(23DIMETHOXYPHENYL)METHYLIDENEAMINO)CARBAMOYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC20H23N3O6Sc162919(25)1511(2)17(12(3)24)3018(15)2220(26)2321101387914(274)16(13)285h710H6H215H3(H2222326)b2110+
MFCD01462768
ZINC000000945258
ZINC32223338

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Available files

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