Vitas-M small molecule compound

N-cyclohexyl-2-[2-(3-methoxy-4-nitro-1H-pyrazol-1-yl)propanoyl]hydrazinecarbothioamide

Catalog ID
STK455934
SMILES COc1nn(cc1[N+](=O)[O-])C(C(=O)NNC(=S)NC1CCCCC1)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 C14H22N6O4S MW 370.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H22N6O4S/c1-9(19-8-11(20(22)23)13(18-19)24-2)12(21)16-17-14(25)15-10-6-4-3-5-7-10/h8-10H,3-7H2,1-2H3,(H,16,21)(H2,15,17,25)
InChIKey
LNLUIWABZVTRBL-UHFFFAOYSA-N
Synonyms

1CYCLOHEXYL3(2(3METHOXY4NITROPYRAZOL1YL)PROPANOYLAMINO)THIOUREA
CC(C(=O)NNC(=S)NC1CCCCC1)N2C=C(C(=N2)OC)(N+)(=O)(O)
COc1nn(cc1(N+)(=O)(O))C(C(=O)NNC(=S)NC1CCCCC1)C
InChI=1SC14H22N6O4Sc19(19811(20(22)23)13(1819)242)12(21)161714(25)15106435710h810H37H212H3(H1621)(H2151725)
MFCD04226156
N(((CYCLOHEXYLAMINO)THIOXOMETHYL)AMINO)2(3METHOXY4NITROPYRAZOLYL)PROPANAMIDE
NCYCLOHEXYL2((2R)2(3METHOXY4NITRO1HPYRAZOL1YL)PROPANOYL)HYDRAZINECARBOTHIOAMIDE
NCYCLOHEXYL2((2S)2(3METHOXY4NITRO1HPYRAZOL1YL)PROPANOYL)HYDRAZINECARBOTHIOAMIDE
Ncyclohexyl2(2(3methoxy4nitro1Hpyrazol1yl)propanoyl)hydrazinecarbothioamide
ZINC000002856783
ZINC000002856784

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Available files

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