Vitas-M small molecule compound

6-[5-(2-methylpropyl)-1H-pyrazol-3-yl]-3-(2-phenylethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Catalog ID
STK631253
SMILES CC(Cc1[nH]nc(c1)c1nn2c(s1)nnc2CCc1ccccc1)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 C18H20N6S MW 352.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N6S/c1-12(2)10-14-11-15(20-19-14)17-23-24-16(21-22-18(24)25-17)9-8-13-6-4-3-5-7-13/h3-7,11-12H,8-10H2,1-2H3,(H,19,20)
InChIKey
SMEQVEVRIWIIAS-UHFFFAOYSA-N
Synonyms
1047983-11-8
1047983118
6(3ISOBUTYL1HPYRAZOL5YL)3(2PHENYLETHYL)(124)TRIAZOLO(34B)(134)THIADIAZOLE
6(3isobutyl1Hpyrazol5yl)3phenethyl(124)triazolo(34b)(134)thiadiazole
6(5(2methylpropyl)1Hpyrazol3yl)3(2phenylethyl)(124)triazolo(34b)(134)thiadiazole
CC(C)CC1=CC(=NN1)C2=NN3C(=NN=C3S2)CCC4=CC=CC=C4
CC(Cc1(nH)nc(c1)c1nn2c(s1)nnc2CCc1ccccc1)C
CC(Cc1n(nH)c(c1)c1nn2c(s1)nnc2CCc1ccccc1)C
InChI=1SC18H20N6Sc112(2)10141115(201914)17232416(212218(24)2517)98136435713h371112H810H212H3(H1920)
MFCD09792637
ZINC000013570578
ZINC13570578

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Available files

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