Vitas-M small molecule compound

methyl 2-[(1,3-benzodioxol-5-ylcarbonyl)amino]-4-(pyridin-3-yl)thiophene-3-carboxylate

Catalog ID
STK463767
SMILES COC(=O)c1c(scc1c1cccnc1)NC(=O)c1ccc2c(c1)OCO2

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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 C19H14N2O5S MW 382.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14N2O5S/c1-24-19(23)16-13(12-3-2-6-20-8-12)9-27-18(16)21-17(22)11-4-5-14-15(7-11)26-10-25-14/h2-9H,10H2,1H3,(H,21,22)
InChIKey
IAGOJVBNJCFBHH-UHFFFAOYSA-N
Synonyms

2((13BENZODIOXOL5YL(OXO)METHYL)AMINO)4(3PYRIDINYL)3THIOPHENECARBOXYLICACIDMETHYLESTER
2(PIPERONYLOYLAMINO)4(3PYRIDYL)THIOPHENE3CARBOXYLICACIDMETHYLESTER
COC(=O)C1=C(SC=C1C2=CN=CC=C2)NC(=O)C3=CC4=C(C=C3)OCO4
InChI=1SC19H14N2O5Sc12419(23)1613(1232620812)92718(16)2117(22)11451415(711)26102514h29H10H21H3(H2122)
methyl2((13benzodioxol5ylcarbonyl)amino)4(pyridin3yl)thiophene3carboxylate
METHYL2(13BENZODIOXOL5YLCARBONYLAMINO)4PYRIDIN3YLTHIOPHENE3CARBOXYLATE
METHYL2(13BENZODIOXOLE5CARBONYLAMINO)4PYRIDIN3YLTHIOPHENE3CARBOXYLATE
METHYL2(2HBENZO(34D)13DIOXOLAN5YLCARBONYLAMINO)4(3PYRIDYL)THIOPHENE3CARBOXYLATE
MFCD06004044
ZINC000001052397
ZINC01052397
ZINC1052397

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Available files

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