Vitas-M small molecule compound
propan-2-yl 2-chloro-5-({[(3-chloro-4-methoxyphenyl)carbonyl]carbamothioyl}amino)benzoate
Catalog ID
STK005296
SMILES COc1ccc(cc1Cl)C(=O)NC(=S)Nc1ccc(c(c1)C(=O)OC(C)C)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 C19H18Cl2N2O4S MW 441.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18Cl2N2O4S/c1-10(2)27-18(25)13-9-12(5-6-14(13)20)22-19(28)23-17(24)11-4-7-16(26-3)15(21)8-11/h4-10H,1-3H3,(H2,22,23,24,28)InChIKey
HJMSYAJNTXLKLW-UHFFFAOYSA-NSynonyms
CC(C)OC(=O)C1=C(C=CC(=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)Cl)Cl
COc1ccc(cc1Cl)C(=O)NC(=S)Nc1ccc(c(c1)C(=O)OC(C)C)Cl
InChI=1SC19H18Cl2N2O4Sc110(2)2718(25)13912(5614(13)20)2219(28)2317(24)114716(263)15(21)811h410H13H3(H222232428)
MFCD03145105
PROPAN2YL2CHLORO5((((3CHLORO4METHOXYPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)BENZOATE
PROPAN2YL2CHLORO5((3CHLORO4METHOXYBENZOYL)CARBAMOTHIOYLAMINO)BENZOATE
STK005296
ZINC000002993327
ZINC02993327
ZINC2993327
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