Vitas-M small molecule compound
6-(1,3-benzodioxol-5-yl)-3-[5-(2-methylpropyl)-1H-pyrazol-3-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STK644297
SMILES CC(Cc1[nH]nc(c1)c1nnc2n1nc(s2)c1ccc2c(c1)OCO2)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 C17H16N6O2S MW 368.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N6O2S/c1-9(2)5-11-7-12(19-18-11)15-20-21-17-23(15)22-16(26-17)10-3-4-13-14(6-10)25-8-24-13/h3-4,6-7,9H,5,8H2,1-2H3,(H,18,19)InChIKey
YRQSVFXMLHGXOT-UHFFFAOYSA-NSynonyms
1160100-92-41160100924
6(13BENZODIOXOL5YL)3(3ISOBUTYL1HPYRAZOL5YL)(124)TRIAZOLO(34B)(134)THIADIAZOLE
6(13benzodioxol5yl)3(5(2methylpropyl)1Hpyrazol3yl)(124)triazolo(34b)(134)thiadiazole
6(benzo(d)(13)dioxol5yl)3(3isobutyl1Hpyrazol5yl)(124)triazolo(34b)(134)thiadiazole
CC(C)CC1=CC(=NN1)C2=NN=C3N2N=C(S3)C4=CC5=C(C=C4)OCO5
CC(Cc1(nH)nc(c1)c1nnc2n1nc(s2)c1ccc2c(c1)OCO2)C
CC(Cc1n(nH)c(c1)c1nnc2n1nc(s2)c1ccc2c(c1)OCO2)C
InChI=1SC17H16N6O2Sc19(2)511712(191811)1520211723(15)2216(2617)10341314(610)2582413h34679H58H212H3(H1819)
MFCD18163577
ZINC000012323701
ZINC12323701
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