Vitas-M small molecule compound

ethyl 4-{[(1-methyl-1H-pyrazol-3-yl)carbonyl]carbamothioyl}piperazine-1-carboxylate

Catalog ID
STK329945
SMILES CCOC(=O)N1CCN(CC1)C(=S)NC(=O)c1ccn(n1)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 C13H19N5O3S MW 325.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H19N5O3S/c1-3-21-13(20)18-8-6-17(7-9-18)12(22)14-11(19)10-4-5-16(2)15-10/h4-5H,3,6-9H2,1-2H3,(H,14,19,22)
InChIKey
PKLPMRCODUJSNC-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCN(CC1)C(=S)NC(=O)C2=NN(C=C2)C
ethyl4(((1methyl1Hpyrazol3yl)carbonyl)carbamothioyl)piperazine1carboxylate
ethyl4((1methylpyrazole3carbonyl)carbamothioyl)piperazine1carboxylate
InChI=1SC13H19N5O3Sc132113(20)188617(7918)12(22)1411(19)104516(2)1510h45H369H212H3(H141922)
MFCD01604967
ZINC000002746677
ZINC02746677
ZINC2746677

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Available files

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