Vitas-M small molecule compound

1'-butyl-3',5'-dimethyl-5-[3-(propan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-1'H,2H-3,4'-bipyrazole

Catalog ID
STK933619
SMILES CCCCn1nc(c(c1C)c1[nH]nc(c1)c1sc2n(n1)c(nn2)C(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 C18H24N8S MW 384.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24N8S/c1-6-7-8-25-12(5)15(11(4)23-25)13-9-14(20-19-13)17-24-26-16(10(2)3)21-22-18(26)27-17/h9-10H,6-8H2,1-5H3,(H,19,20)
InChIKey
SDVIYEUTFVUTOT-UHFFFAOYSA-N
Synonyms
1239971-41-5
1239971415
1butyl35dimethyl5(3(propan2yl)(124)triazolo(34b)(134)thiadiazol6yl)1H2H34bipyrazole
6(1butyl35dimethyl1H1H(34bipyrazol)5yl)3isopropyl(124)triazolo(34b)(134)thiadiazole
6(3(1butyl35dimethylpyrazol4yl)1Hpyrazol5yl)3propan2yl(124)triazolo(34b)(134)thiadiazole
CCCCN1C(=C(C(=N1)C)C2=NNC(=C2)C3=NN4C(=NN=C4S3)C(C)C)C
CCCCn1nc(c(c1C)c1(nH)nc(c1)c1sc2n(n1)c(nn2)C(C)C)C
CCCCn1nc(c(c1C)c1n(nH)c(c1)c1sc2n(n1)c(nn2)C(C)C)C
InChI=1SC18H24N8Sc16782512(5)15(11(4)2325)13914(201913)17242616(10(2)3)212218(26)2717h910H68H215H3(H1920)
MFCD18177560
ZINC000036360284
ZINC36360284

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Available files

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