Vitas-M small molecule compound

2-[(4-chloro-1,3-dimethyl-1H-pyrazol-5-yl)carbonyl]-N-(3-ethoxypropyl)hydrazinecarbothioamide

Catalog ID
STK302042
SMILES CCOCCCNC(=S)NNC(=O)c1n(C)nc(c1Cl)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 C12H20ClN5O2S MW 333.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H20ClN5O2S/c1-4-20-7-5-6-14-12(21)16-15-11(19)10-9(13)8(2)17-18(10)3/h4-7H2,1-3H3,(H,15,19)(H2,14,16,21)
InChIKey
RPZDSTREHJHICK-UHFFFAOYSA-N
Synonyms
512814-26-5
1((4CHLORO25DIMETHYLPYRAZOLE3CARBONYL)AMINO)3(3ETHOXYPROPYL)THIOUREA
2((4chloro13dimethyl1Hpyrazol5yl)carbonyl)N(3ethoxypropyl)hydrazinecarbothioamide
512814265
CCOCCCNC(=S)NNC(=O)C1=C(C(=NN1C)C)Cl
InChI=1SC12H20ClN5O2Sc14207561412(21)161511(19)109(13)8(2)1718(10)3h47H213H3(H1519)(H2141621)
MFCD03466866
ZINC000002760406
ZINC02760406
ZINC2760406

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Available files

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