Vitas-M small molecule compound

6-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(4-phenylpiperazin-1-yl)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Catalog ID
STL112629
SMILES c1ccc(cc1)N1CCN(CC1)Cc1nnc2n1nc(s2)c1ccc2c(c1)OCCO2

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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 C22H22N6O2S MW 434.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N6O2S/c1-2-4-17(5-3-1)27-10-8-26(9-11-27)15-20-23-24-22-28(20)25-21(31-22)16-6-7-18-19(14-16)30-13-12-29-18/h1-7,14H,8-13,15H2
InChIKey
KDFSAEHFDPINLV-UHFFFAOYSA-N
Synonyms

6(23dihydro14benzodioxin6yl)3((4phenylpiperazin1yl)methyl)(124)triazolo(34b)(134)thiadiazole
C1CN(CCN1CC2=NN=C3N2N=C(S3)C4=CC5=C(C=C4)OCCO5)C6=CC=CC=C6
InChI=1SC22H22N6O2Sc12417(531)2710826(91127)152023242228(20)2521(3122)16671819(1416)3013122918h1714H81315H2
MFCD18484998
ZINC000065362865
ZINC65362865

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Available files

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