Vitas-M small molecule compound
4-[3-(azepan-1-ylmethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-phenylquinoline
Catalog ID
STL300340
SMILES C1CCCN(CC1)Cc1nnc2n1nc(s2)c1cc(nc2c1cccc2)c1ccccc1
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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 C25H24N6S MW 440.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N6S/c1-2-9-15-30(14-8-1)17-23-27-28-25-31(23)29-24(32-25)20-16-22(18-10-4-3-5-11-18)26-21-13-7-6-12-19(20)21/h3-7,10-13,16H,1-2,8-9,14-15,17H2InChIKey
NGKDUUKDTZXPCW-UHFFFAOYSA-NSynonyms
3(azepan1ylmethyl)6(2phenylquinolin4yl)(124)triazolo(34b)(134)thiadiazole
4(3(1AZEPANYLMETHYL)(124)TRIAZOLO(34B)(134)THIADIAZOL6YL)2PHENYLQUINOLINE
4(3(azepan1ylmethyl)(124)triazolo(34b)(134)thiadiazol6yl)2phenylquinoline
C1CCCN(CC1)CC2=NN=C3N2N=C(S3)C4=CC(=NC5=CC=CC=C54)C6=CC=CC=C6
InChI=1SC25H24N6Sc1291530(1481)172327282531(23)2924(3225)201622(18104351118)262113761219(20)21h37101316H1289141517H2
MFCD22543755
ZINC000071260620
ZINC71260620
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