Vitas-M small molecule compound
methyl 2-chloro-5-({[(3,4,5-triethoxyphenyl)carbonyl]carbamothioyl}amino)benzoate
Catalog ID
STL432575
SMILES CCOc1cc(cc(c1OCC)OCC)C(=O)NC(=S)Nc1ccc(c(c1)C(=O)OC)Cl
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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 C22H25ClN2O6S MW 480.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25ClN2O6S/c1-5-29-17-10-13(11-18(30-6-2)19(17)31-7-3)20(26)25-22(32)24-14-8-9-16(23)15(12-14)21(27)28-4/h8-12H,5-7H2,1-4H3,(H2,24,25,26,32)InChIKey
DTGXGTVYLOWOFM-UHFFFAOYSA-NSynonyms
CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=CC(=C(C=C2)Cl)C(=O)OC
InChI=1SC22H25ClN2O6Sc1529171013(1118(3062)19(17)3173)20(26)2522(32)24148916(23)15(1214)21(27)284h812H57H214H3(H224252632)
methyl2chloro5((((345triethoxyphenyl)carbonyl)carbamothioyl)amino)benzoate
METHYL2CHLORO5((345TRIETHOXYBENZOYL)CARBAMOTHIOYLAMINO)BENZOATE
MFCD03307357
ZINC000016688387
ZINC16688387
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