Vitas-M small molecule compound

N,N'-(octane-1,8-diyldi-1,3,4-thiadiazol-2-yl-5-ylidene)bis(2-methylpropanamide)

Catalog ID
STK567515
SMILES CC(C(=O)/N=c\1/[nH]nc(s1)CCCCCCCCc1n[nH]/c(=N/C(=O)C(C)C)/s1)C

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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 C20H32N6O2S2 MW 452.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H32N6O2S2/c1-13(2)17(27)21-19-25-23-15(29-19)11-9-7-5-6-8-10-12-16-24-26-20(30-16)22-18(28)14(3)4/h13-14H,5-12H2,1-4H3,(H,21,25,27)(H,22,26,28)
InChIKey
ZSJXHZMYRXDJTQ-UHFFFAOYSA-N
Synonyms
714228-22-5
714228225
CC(C(=O)N=c1(nH)nc(s1)CCCCCCCCc1n(nH)c(=NC(=O)C(C)C)s1)C
MFCD05728203
ZINC000017208222

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.