Vitas-M small molecule compound
6-(1,3-benzodioxol-5-yl)-3-[(4-phenylpiperazin-1-yl)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL112628
SMILES c1ccc(cc1)N1CCN(CC1)Cc1nnc2n1nc(s2)c1ccc2c(c1)OCO2
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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 C21H20N6O2S MW 420.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N6O2S/c1-2-4-16(5-3-1)26-10-8-25(9-11-26)13-19-22-23-21-27(19)24-20(30-21)15-6-7-17-18(12-15)29-14-28-17/h1-7,12H,8-11,13-14H2InChIKey
SDQVMCMWCGETTD-UHFFFAOYSA-NSynonyms
6(13benzodioxol5yl)3((4phenylpiperazin1yl)methyl)(124)triazolo(34b)(134)thiadiazole
C1CN(CCN1CC2=NN=C3N2N=C(S3)C4=CC5=C(C=C4)OCO5)C6=CC=CC=C6
InChI=1SC21H20N6O2Sc12416(531)2610825(91126)131922232127(19)2420(3021)15671718(1215)29142817h1712H8111314H2
MFCD18488721
ZINC000065365931
ZINC65365931
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