Vitas-M small molecule compound
(2E)-3-[5-(2,4-dichlorophenyl)furan-2-yl]-N-[(pyridin-3-ylmethyl)carbamothioyl]prop-2-enamide
Catalog ID
STL089007
SMILES S=C(NC(=O)/C=C/c1ccc(o1)c1ccc(cc1Cl)Cl)NCc1cccnc1
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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 C20H15Cl2N3O2S MW 432.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15Cl2N3O2S/c21-14-3-6-16(17(22)10-14)18-7-4-15(27-18)5-8-19(26)25-20(28)24-12-13-2-1-9-23-11-13/h1-11H,12H2,(H2,24,25,26,28)/b8-5+InChIKey
FKQLPYNFQKIPNP-VMPITWQZSA-NSynonyms
(2E)3(5(24dichlorophenyl)furan2yl)N((pyridin3ylmethyl)carbamothioyl)prop2enamide
(E)3(5(24dichlorophenyl)furan2yl)N(pyridin3ylmethylcarbamothioyl)prop2enamide
C1=CC(=CN=C1)CNC(=S)NC(=O)C=CC2=CC=C(O2)C3=C(C=C(C=C3)Cl)Cl
InChI=1SC20H15Cl2N3O2Sc21143616(17(22)1014)187415(2718)5819(26)2520(28)241213219231113h111H12H2(H224252628)b85+
MFCD05848379
S=C(NC(=O)C=Cc1ccc(o1)c1ccc(cc1Cl)Cl)NCc1cccnc1
ZINC000017097826
ZINC17097826
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