Vitas-M small molecule compound
ethyl 4-({[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]carbamothioyl}amino)benzoate
Catalog ID
STL396333
SMILES CCOC(=O)c1ccc(cc1)NC(=S)NC(=O)c1c(Cl)cnn1CC
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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 C16H17ClN4O3S MW 380.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17ClN4O3S/c1-3-21-13(12(17)9-18-21)14(22)20-16(25)19-11-7-5-10(6-8-11)15(23)24-4-2/h5-9H,3-4H2,1-2H3,(H2,19,20,22,25)InChIKey
CCALJYYMCVUYQH-UHFFFAOYSA-NSynonyms
494218-54-1494218541
CCN1C(=C(C=N1)Cl)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)OCC
ETHYL4((((4CHLORO1ETHYL1HPYRAZOL5YL)CARBONYL)CARBAMOTHIOYL)AMINO)BENZOATE
ETHYL4((((4CHLORO1ETHYLPYRAZOL5YL)CARBONYLAMINO)THIOXOMETHYL)AMINO)BENZOATE
ETHYL4((4CHLORO2ETHYLPYRAZOLE3CARBONYL)CARBAMOTHIOYLAMINO)BENZOATE
InChI=1SC16H17ClN4O3Sc132113(12(17)91821)14(22)2016(25)19117510(6811)15(23)2442h59H34H212H3(H219202225)
MFCD02374125
ZINC000000649610
ZINC00649610
ZINC649610
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