Vitas-M small molecule compound
3-(azepan-1-ylmethyl)-6-(3,4-dichlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL300337
SMILES Clc1ccc(cc1Cl)c1nn2c(s1)nnc2CN1CCCCCC1
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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 C16H17Cl2N5S MW 382.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17Cl2N5S/c17-12-6-5-11(9-13(12)18)15-21-23-14(19-20-16(23)24-15)10-22-7-3-1-2-4-8-22/h5-6,9H,1-4,7-8,10H2InChIKey
RIQVFONAAVEJCJ-UHFFFAOYSA-NSynonyms
3(1AZEPANYLMETHYL)6(34DICHLOROPHENYL)(124)TRIAZOLO(34B)(134)THIADIAZOLE
3(azepan1ylmethyl)6(34dichlorophenyl)(124)triazolo(34b)(134)thiadiazole
C1CCCN(CC1)CC2=NN=C3N2N=C(S3)C4=CC(=C(C=C4)Cl)Cl
InChI=1SC16H17Cl2N5Sc17126511(913(12)18)15212314(192016(23)2415)102273124822h569H147810H2
MFCD22375588
ZINC000071260589
ZINC71260589
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