Vitas-M small molecule compound
3-(azepan-1-ylmethyl)-6-(naphthalen-1-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL086155
SMILES C1CCCN(CC1)Cc1nnc2n1nc(s2)c1cccc2c1cccc2
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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 C20H21N5S MW 363.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5S/c1-2-6-13-24(12-5-1)14-18-21-22-20-25(18)23-19(26-20)17-11-7-9-15-8-3-4-10-16(15)17/h3-4,7-11H,1-2,5-6,12-14H2InChIKey
NVVTWULIRKRFMZ-UHFFFAOYSA-NSynonyms
1261014-50-91261014509
3(1AZEPANYLMETHYL)6(1NAPHTHYL)(124)TRIAZOLO(34B)(134)THIADIAZOLE
3(azepan1ylmethyl)6(naphthalen1yl)(124)triazolo(34b)(134)thiadiazole
3(azepan1ylmethyl)6naphthalen1yl(124)triazolo(34b)(134)thiadiazole
C1CCCN(CC1)CC2=NN=C3N2N=C(S3)C4=CC=CC5=CC=CC=C54
InChI=1SC20H21N5Sc1261324(1251)141821222025(18)2319(2620)171179158341016(15)17h34711H12561214H2
MFCD18203605
ZINC000057524591
ZINC57524591
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