Vitas-M small molecule compound
4-[4-(4-chlorophenyl)piperazin-1-yl]-4-oxo-N-[(2Z)-5-(trifluoromethyl)-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
Catalog ID
STL054510
SMILES O=C(N1CCN(CC1)c1ccc(cc1)Cl)CCC(=O)/N=c\1/[nH]nc(s1)C(F)(F)F
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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 C17H17ClF3N5O2S MW 447.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClF3N5O2S/c18-11-1-3-12(4-2-11)25-7-9-26(10-8-25)14(28)6-5-13(27)22-16-24-23-15(29-16)17(19,20)21/h1-4H,5-10H2,(H,22,24,27)InChIKey
LJRFKUFQDUVIPW-UHFFFAOYSA-NSynonyms
714228-60-14(4(4chlorophenyl)piperazin1yl)4oxoN((2Z)5(trifluoromethyl)134thiadiazol2(3H)ylidene)butanamide
4(4(4CHLOROPHENYL)PIPERAZIN1YL)4OXON(5(TRIFLUOROMETHYL)134THIADIAZOL2YL)BUTANAMIDE
714228601
C1CN(CCN1C2=CC=C(C=C2)Cl)C(=O)CCC(=O)NC3=NN=C(S3)C(F)(F)F
InChI=1SC17H17ClF3N5O2Sc18111312(4211)257926(10825)14(28)6513(27)2216242315(2916)17(1920)21h14H510H2(H222427)
MFCD05728263
O=C(N1CCN(CC1)c1ccc(cc1)Cl)CCC(=O)N=c1(nH)nc(s1)C(F)(F)F
ZINC000017208257
ZINC17208257
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