Vitas-M small molecule compound
4-[(Z)-{3,5-dioxo-1-[3-(trifluoromethyl)phenyl]pyrazolidin-4-ylidene}methyl]-2-ethoxyphenyl thiophene-2-carboxylate
Catalog ID
STL432637
SMILES CCOc1cc(ccc1OC(=O)c1cccs1)/C=C\1/C(=O)NN(C1=O)c1cccc(c1)C(F)(F)F
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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 C24H17F3N2O5S MW 502.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17F3N2O5S/c1-2-33-19-12-14(8-9-18(19)34-23(32)20-7-4-10-35-20)11-17-21(30)28-29(22(17)31)16-6-3-5-15(13-16)24(25,26)27/h3-13H,2H2,1H3,(H,28,30)/b17-11-InChIKey
SUOVGVUBKHBVOF-BOPFTXTBSA-NSynonyms
(4((Z)(35DIOXO1(3(TRIFLUOROMETHYL)PHENYL)PYRAZOLIDIN4YLIDENE)METHYL)2ETHOXYPHENYL)THIOPHENE2CARBOXYLATE
4((35DIOXO1(3(TRIFLUOROMETHYL)PHENYL)(12DIAZOLIDIN4YLIDENE))METHYL)2ETHOXYPHENYLTHIOPHENE2CARBOXYLATE
4((Z)(35dioxo1(3(trifluoromethyl)phenyl)pyrazolidin4ylidene)methyl)2ethoxyphenylthiophene2carboxylate
CCOC1=C(C=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC=CC(=C3)C(F)(F)F)OC(=O)C4=CC=CS4
CCOc1cc(ccc1OC(=O)c1cccs1)C=C1C(=O)NN(C1=O)c1cccc(c1)C(F)(F)F
InChI=1SC24H17F3N2O5Sc1233191214(8918(19)3423(32)2074103520)111721(30)2829(22(17)31)1663515(1316)24(2526)27h313H2H21H3(H2830)b1711
MFCD03217369
ZINC000012411519
ZINC12411519
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