Vitas-M small molecule compound
ethyl 2-({[(3-bromo-4-methoxyphenyl)carbonyl]carbamothioyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Catalog ID
STK163897
SMILES CCOC(=O)c1c(NC(=S)NC(=O)c2ccc(c(c2)Br)OC)sc2c1CCC2
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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 C19H19BrN2O4S2 MW 483.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19BrN2O4S2/c1-3-26-18(24)15-11-5-4-6-14(11)28-17(15)22-19(27)21-16(23)10-7-8-13(25-2)12(20)9-10/h7-9H,3-6H2,1-2H3,(H2,21,22,23,27)InChIKey
SFFDQFXTANJRCQ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCC2)NC(=S)NC(=O)C3=CC(=C(C=C3)OC)Br
ETHYL2((((3BROMO4METHOXYPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
ETHYL2((3BROMO4METHOXYBENZOYL)CARBAMOTHIOYLAMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
InChI=1SC19H19BrN2O4S2c132618(24)151154614(11)2817(15)2219(27)2116(23)107813(252)12(20)910h79H36H212H3(H221222327)
MFCD03079753
ZINC000000678683
ZINC00678683
ZINC678683
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