Vitas-M small molecule compound
ethyl 2-[(1,3-benzodioxol-5-ylcarbonyl)amino]-4-(4-bromophenyl)thiophene-3-carboxylate
Catalog ID
STK453051
SMILES CCOC(=O)c1c(scc1c1ccc(cc1)Br)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 C21H16BrNO5S MW 474.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16BrNO5S/c1-2-26-21(25)18-15(12-3-6-14(22)7-4-12)10-29-20(18)23-19(24)13-5-8-16-17(9-13)28-11-27-16/h3-10H,2,11H2,1H3,(H,23,24)InChIKey
QWIWSDPBSVYWNM-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)C3=CC4=C(C=C3)OCO4
ethyl2((13benzodioxol5ylcarbonyl)amino)4(4bromophenyl)thiophene3carboxylate
ETHYL2(13BENZODIOXOLE5CARBONYLAMINO)4(4BROMOPHENYL)THIOPHENE3CARBOXYLATE
ETHYL2(2HBENZO(34D)13DIOXOLAN5YLCARBONYLAMINO)4(4BROMOPHENYL)THIOPHENE3CARBOXYLATE
InChI=1SC21H16BrNO5Sc122621(25)1815(123614(22)7412)102920(18)2319(24)13581617(913)28112716h310H211H21H3(H2324)
MFCD02606577
ZINC000002761517
ZINC02761517
ZINC2761517
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