Vitas-M small molecule compound

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

Catalog ID
STL086078
SMILES Clc1ccc(cc1)Cc1nnc2n1nc(s2)c1[nH]nc(c1)C(C)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 C16H15ClN6S MW 358.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15ClN6S/c1-9(2)12-8-13(19-18-12)15-22-23-14(20-21-16(23)24-15)7-10-3-5-11(17)6-4-10/h3-6,8-9H,7H2,1-2H3,(H,18,19)
InChIKey
JTAUQSZQNOFOAC-UHFFFAOYSA-N
Synonyms
1187563-78-5
1187563785
3((4chlorophenyl)methyl)6(5propan2yl1Hpyrazol3yl)(124)triazolo(34b)(134)thiadiazole
3(4chlorobenzyl)6(3(propan2yl)1Hpyrazol5yl)(124)triazolo(34b)(134)thiadiazole
3(4chlorobenzyl)6(3isopropyl1Hpyrazol5yl)(124)triazolo(34b)(134)thiadiazole
CC(C)C1=CC(=NN1)C2=NN3C(=NN=C3S2)CC4=CC=C(C=C4)Cl
Clc1ccc(cc1)Cc1nnc2n1nc(s2)c1(nH)nc(c1)C(C)C
InChI=1SC16H15ClN6Sc19(2)12813(191812)15222314(202116(23)2415)7103511(17)6410h3689H7H212H3(H1819)
MFCD13956621
ZINC000022504526
ZINC22504526

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Available files

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