Vitas-M small molecule compound
(2E)-3-(furan-2-yl)-N-{[2-(pyrrolidin-1-yl)-5-(trifluoromethyl)phenyl]carbamothioyl}prop-2-enamide
Catalog ID
STK389922
SMILES S=C(Nc1cc(ccc1N1CCCC1)C(F)(F)F)NC(=O)/C=C/c1ccco1
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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 C19H18F3N3O2S MW 409.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18F3N3O2S/c20-19(21,22)13-5-7-16(25-9-1-2-10-25)15(12-13)23-18(28)24-17(26)8-6-14-4-3-11-27-14/h3-8,11-12H,1-2,9-10H2,(H2,23,24,26,28)/b8-6+InChIKey
IQJAZALLWWSBJI-SOFGYWHQSA-NSynonyms
(2E)3(2FURYL)N(((2PYRROLIDINYL5(TRIFLUOROMETHYL)PHENYL)AMINO)THIOXOMETHYL)PROP2ENAMIDE
(2E)3(furan2yl)N((2(pyrrolidin1yl)5(trifluoromethyl)phenyl)carbamothioyl)prop2enamide
(E)3(FURAN2YL)N((2PYRROLIDIN1YL5(TRIFLUOROMETHYL)PHENYL)CARBAMOTHIOYL)PROP2ENAMIDE
C1CCN(C1)C2=C(C=C(C=C2)C(F)(F)F)NC(=S)NC(=O)C=CC3=CC=CO3
InChI=1SC19H18F3N3O2Sc2019(2122)135716(259121025)15(1213)2318(28)2417(26)861443112714h381112H12910H2(H223242628)b86+
MFCD05661590
S=C(Nc1cc(ccc1N1CCCC1)C(F)(F)F)NC(=O)C=Cc1ccco1
ZINC000004109831
ZINC04109831
ZINC4109831
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