Vitas-M small molecule compound
N,N-diethyl-4-[3-(5-phenyl-1H-pyrazol-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]aniline
Catalog ID
STL042153
SMILES CCN(c1ccc(cc1)c1nn2c(s1)nnc2c1n[nH]c(c1)c1ccccc1)CC
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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 C22H21N7S MW 415.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N7S/c1-3-28(4-2)17-12-10-16(11-13-17)21-27-29-20(25-26-22(29)30-21)19-14-18(23-24-19)15-8-6-5-7-9-15/h5-14H,3-4H2,1-2H3,(H,23,24)InChIKey
PZAMSJDWXZQJIM-UHFFFAOYSA-NSynonyms
1037565-37-91037565379
CCN(c1ccc(cc1)c1nn2c(s1)nnc2c1(nH)nc(c1)c1ccccc1)CC
CCN(c1ccc(cc1)c1nn2c(s1)nnc2c1n(nH)c(c1)c1ccccc1)CC
CCN(CC)C1=CC=C(C=C1)C2=NN3C(=NN=C3S2)C4=CC(=NN4)C5=CC=CC=C5
DIETHYL(4(3(3PHENYLPYRAZOL5YL)(124TRIAZOLO(34B)134THIADIAZOLIN6YL))PHENYL)AMINE
InChI=1SC22H21N7Sc1328(42)17121016(111317)21272920(252622(29)3021)191418(232419)158657915h514H34H212H3(H2324)
MFCD05728260
NNDIETHYL4(3(3PHENYL1HPYRAZOL5YL)(124)TRIAZOLO(34B)(134)THIADIAZOL6YL)ANILINE
NNdiethyl4(3(5phenyl1Hpyrazol3yl)(124)triazolo(34b)(134)thiadiazol6yl)aniline
ZINC000005458800
ZINC05458800
ZINC5458800
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