Vitas-M small molecule compound
benzyl (1-{[(2,4-dichlorophenyl)carbonyl]carbamothioyl}-3-oxopiperazin-2-yl)acetate
Catalog ID
STL064263
SMILES O=C(CC1C(=O)NCCN1C(=S)NC(=O)c1ccc(cc1Cl)Cl)OCc1ccccc1
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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 C21H19Cl2N3O4S MW 480.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19Cl2N3O4S/c22-14-6-7-15(16(23)10-14)19(28)25-21(31)26-9-8-24-20(29)17(26)11-18(27)30-12-13-4-2-1-3-5-13/h1-7,10,17H,8-9,11-12H2,(H,24,29)(H,25,28,31)InChIKey
XORSWISJPMXVJM-UHFFFAOYSA-NSynonyms
1033588-57-61033588576
benzyl(1(((24dichlorophenyl)carbonyl)carbamothioyl)3oxopiperazin2yl)acetate
BENZYL2(1((24DICHLOROBENZOYL)CARBAMOTHIOYL)3OXOPIPERAZIN2YL)ACETATE
C1CN(C(C(=O)N1)CC(=O)OCC2=CC=CC=C2)C(=S)NC(=O)C3=C(C=C(C=C3)Cl)Cl
InChI=1SC21H19Cl2N3O4Sc22146715(16(23)1014)19(28)2521(31)26982420(29)17(26)1118(27)3012134213513h171017H891112H2(H2429)(H252831)
MFCD05127924
ZINC000010382138
ZINC000010382142
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