Vitas-M small molecule compound
4-oxo-4-(4-phenylpiperazin-1-yl)-N-[(2Z)-5-(trifluoromethyl)-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
Catalog ID
STL057749
SMILES O=C(N1CCN(CC1)c1ccccc1)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 C17H18F3N5O2S MW 413.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18F3N5O2S/c18-17(19,20)15-22-23-16(28-15)21-13(26)6-7-14(27)25-10-8-24(9-11-25)12-4-2-1-3-5-12/h1-5H,6-11H2,(H,21,23,26)InChIKey
OKDDDWKXXXPRAZ-UHFFFAOYSA-NSynonyms
4oxo4(4phenylpiperazin1yl)N((2Z)5(trifluoromethyl)134thiadiazol2(3H)ylidene)butanamide
4OXO4(4PHENYLPIPERAZIN1YL)N(5(TRIFLUOROMETHYL)134THIADIAZOL2YL)BUTANAMIDE
C1CN(CCN1C2=CC=CC=C2)C(=O)CCC(=O)NC3=NN=C(S3)C(F)(F)F
InChI=1SC17H18F3N5O2Sc1817(1920)15222316(2815)2113(26)6714(27)2510824(91125)124213512h15H611H2(H212326)
MFCD05734083
O=C(N1CCN(CC1)c1ccccc1)CCC(=O)N=c1(nH)nc(s1)C(F)(F)F
ZINC000002432525
ZINC02432525
ZINC2432525
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