Vitas-M small molecule compound

methyl 4-cyano-5-{[(4-ethoxyphenyl)carbonyl]amino}-3-methylthiophene-2-carboxylate

Catalog ID
STK324452
SMILES CCOc1ccc(cc1)C(=O)Nc1sc(c(c1C#N)C)C(=O)OC

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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 C17H16N2O4S MW 344.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O4S/c1-4-23-12-7-5-11(6-8-12)15(20)19-16-13(9-18)10(2)14(24-16)17(21)22-3/h5-8H,4H2,1-3H3,(H,19,20)
InChIKey
KPDOLBKQHLDGCC-UHFFFAOYSA-N
Synonyms

CCOC1=CC=C(C=C1)C(=O)NC2=C(C(=C(S2)C(=O)OC)C)C#N
InChI=1SC17H16N2O4Sc1423127511(6812)15(20)191613(918)10(2)14(2416)17(21)223h58H4H213H3(H1920)
methyl4cyano5(((4ethoxyphenyl)carbonyl)amino)3methylthiophene2carboxylate
METHYL4CYANO5((4ETHOXYBENZOYL)AMINO)3METHYL2THIOPHENECARBOXYLATE
METHYL4CYANO5((4ETHOXYBENZOYL)AMINO)3METHYLTHIOPHENE2CARBOXYLATE
METHYL4CYANO5(4ETHOXYBENZAMIDO)3METHYLTHIOPHENE2CARBOXYLATE
MFCD03242761
ZINC000004537767
ZINC04537767
ZINC4537767

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Available files

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