Vitas-M small molecule compound
2-(1,3-benzothiazol-2-yl)-1,2,4-triazaspiro[4.11]hexadecane-3-thione
Catalog ID
STL181349
SMILES S=C1NC2(NN1c1nc3c(s1)cccc3)CCCCCCCCCCC2
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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 C20H28N4S2 MW 388.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28N4S2/c25-18-22-20(14-10-6-4-2-1-3-5-7-11-15-20)23-24(18)19-21-16-12-8-9-13-17(16)26-19/h8-9,12-13,23H,1-7,10-11,14-15H2,(H,22,25)InChIKey
NAZRRBYKFKOZHR-UHFFFAOYSA-NSynonyms
2(13benzothiazol2yl)124triazaspiro(411)hexadecane3thione
C1CCCCCC2(CCCCC1)NC(=S)N(N2)C3=NC4=CC=CC=C4S3
InChI=1SC20H28N4S2c25182220(14106421357111520)2324(18)19211612891317(16)2619h89121323H1710111415H2(H2225)
MFCD02243184
ZINC000002768883
ZINC02768883
ZINC2768883
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