Vitas-M small molecule compound
4-{(Z)-[1-(4-fluorophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}phenyl thiophene-2-carboxylate
Catalog ID
STL432670
SMILES Fc1ccc(cc1)N1NC(=O)/C(=C/c2ccc(cc2)OC(=O)c2cccs2)/C1=O
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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 C21H13FN2O4S MW 408.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13FN2O4S/c22-14-5-7-15(8-6-14)24-20(26)17(19(25)23-24)12-13-3-9-16(10-4-13)28-21(27)18-2-1-11-29-18/h1-12H,(H,23,25)/b17-12-InChIKey
BUOJCHRGKHNYHU-ATVHPVEESA-NSynonyms
(4((Z)(1(4FLUOROPHENYL)35DIOXOPYRAZOLIDIN4YLIDENE)METHYL)PHENYL)THIOPHENE2CARBOXYLATE
4((Z)(1(4fluorophenyl)35dioxopyrazolidin4ylidene)methyl)phenylthiophene2carboxylate
C1=CSC(=C1)C(=O)OC2=CC=C(C=C2)C=C3C(=O)NN(C3=O)C4=CC=C(C=C4)F
Fc1ccc(cc1)N1NC(=O)C(=Cc2ccc(cc2)OC(=O)c2cccs2)C1=O
InChI=1SC21H13FN2O4Sc22145715(8614)2420(26)17(19(25)2324)12133916(10413)2821(27)1821112918h112H(H2325)b1712
MFCD03721476
ZINC000001131638
ZINC01131638
ZINC1131638
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