Vitas-M small molecule compound

trans-N-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]-4-(1H-tetrazol-1-ylmethyl)cyclohexanecarboxamide

Catalog ID
STK934021
SMILES CCc1n[nH]/c(=N/C(=O)C2CC[C@H](CC2)Cn2cnnn2)/s1

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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 C13H19N7OS MW 321.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H19N7OS/c1-2-11-16-17-13(22-11)15-12(21)10-5-3-9(4-6-10)7-20-8-14-18-19-20/h8-10H,2-7H2,1H3,(H,15,17,21)/t9-,10?
InChIKey
XKVDTHQHKPTILZ-OKXAEBFBSA-N
Synonyms

CCc1n(nH)c(=NC(=O)C2CC(C@H)(CC2)Cn2cnnn2)s1
MFCD18177679
transN((2Z)5ethyl134thiadiazol2(3H)ylidene)4(1Htetrazol1ylmethyl)cyclohexanecarboxamide
ZINC000044900510

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Available files

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