Vitas-M small molecule compound
ethyl (2Z)-2-({[2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl]carbonyl}imino)-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL314555
SMILES CCOC(=O)c1cs/c(=N\C(=O)c2ccc(cc2Cl)N2CCCCS2(=O)=O)/[nH]1
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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 C17H18ClN3O5S2 MW 443.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18ClN3O5S2/c1-2-26-16(23)14-10-27-17(19-14)20-15(22)12-6-5-11(9-13(12)18)21-7-3-4-8-28(21,24)25/h5-6,9-10H,2-4,7-8H2,1H3,(H,19,20,22)InChIKey
FPKOGMZWHUZAFG-UHFFFAOYSA-NSynonyms
1401541-30-71401541307
CCOC(=O)C1=CSC(=N1)NC(=O)C2=C(C=C(C=C2)N3CCCCS3(=O)=O)Cl
CCOC(=O)c1csc(=NC(=O)c2ccc(cc2Cl)N2CCCCS2(=O)=O)(nH)1
ethyl(2Z)2(((2chloro4(11dioxido12thiazinan2yl)phenyl)carbonyl)imino)23dihydro13thiazole4carboxylate
ethyl2((2chloro4(11dioxothiazinan2yl)benzoyl)amino)13thiazole4carboxylate
InChI=1SC17H18ClN3O5S2c122616(23)14102717(1914)2015(22)126511(913(12)18)21734828(2124)25h56910H2478H21H3(H192022)
MFCD28030783
ZINC000079476938
ZINC79476938
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