Vitas-M small molecule compound
methyl 2-[(1,3-benzodioxol-5-ylcarbonyl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate
Catalog ID
STK427770
SMILES COC(=O)c1c(scc1c1ccc(cc1)C)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 C21H17NO5S MW 395.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17NO5S/c1-12-3-5-13(6-4-12)15-10-28-20(18(15)21(24)25-2)22-19(23)14-7-8-16-17(9-14)27-11-26-16/h3-10H,11H2,1-2H3,(H,22,23)InChIKey
LJOFPCFJWXGLCP-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)C3=CC4=C(C=C3)OCO4
InChI=1SC21H17NO5Sc1123513(6412)15102820(18(15)21(24)252)2219(23)14781617(914)27112616h310H11H212H3(H2223)
methyl2((13benzodioxol5ylcarbonyl)amino)4(4methylphenyl)thiophene3carboxylate
METHYL2(13BENZODIOXOLE5CARBONYLAMINO)4(4METHYLPHENYL)THIOPHENE3CARBOXYLATE
METHYL2(2HBENZO(34D)13DIOXOLAN5YLCARBONYLAMINO)4(4METHYLPHENYL)THIOPHENE3CARBOXYLATE
MFCD03389956
ZINC000002749876
ZINC02749876
ZINC2749876
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