Vitas-M small molecule compound
N-(2,2,2-trichloro-1-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)carbamothioyl]amino}ethyl)propanamide
Catalog ID
STK808553
SMILES CCC(=O)NC(C(Cl)(Cl)Cl)NC(=S)Nc1c(C)n(n(c1=O)c1ccccc1)C
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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 C17H20Cl3N5O2S MW 464.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20Cl3N5O2S/c1-4-12(26)21-15(17(18,19)20)23-16(28)22-13-10(2)24(3)25(14(13)27)11-8-6-5-7-9-11/h5-9,15H,4H2,1-3H3,(H,21,26)(H2,22,23,28)InChIKey
HRKJWPNXWYFFIE-UHFFFAOYSA-NSynonyms
324769-65-5324769655
CCC(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC1=C(N(N(C1=O)C2=CC=CC=C2)C)C
InChI=1SC17H20Cl3N5O2Sc1412(26)2115(17(1819)20)2316(28)221310(2)24(3)25(14(13)27)118657911h5915H4H213H3(H2126)(H2222328)
MFCD00548684
N(222trichloro1(((15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)carbamothioyl)amino)ethyl)propanamide
N(222TRICHLORO1((15DIMETHYL3OXO2PHENYLPYRAZOL4YL)CARBAMOTHIOYLAMINO)ETHYL)PROPANAMIDE
N(222TRICHLORO1(3(15DIMETHYL3OXO2PHENYL23DIHYDRO1HPYRAZOL4YL)THIOUREIDO)ETHYL)PROPIONAMIDE
ZINC000008691453
ZINC000008691454
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