Vitas-M small molecule compound

ethyl 4-[(4-butylphenyl)carbamothioyl]piperazine-1-carboxylate

Catalog ID
STK143538
SMILES CCCCc1ccc(cc1)NC(=S)N1CCN(CC1)C(=O)OCC

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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 C18H27N3O2S MW 349.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H27N3O2S/c1-3-5-6-15-7-9-16(10-8-15)19-17(24)20-11-13-21(14-12-20)18(22)23-4-2/h7-10H,3-6,11-14H2,1-2H3,(H,19,24)
InChIKey
AIXLBYYCNAGIEU-UHFFFAOYSA-N
Synonyms

CCCCC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C(=O)OCC
ETHYL4(((4BUTYLPHENYL)AMINO)THIOXOMETHYL)PIPERAZINECARBOXYLATE
ETHYL4((4BUTYLPHENYL)CARBAMOTHIOYL)PIPERAZINE1CARBOXYLATE
InChI=1SC18H27N3O2Sc1356157916(10815)1917(24)20111321(141220)18(22)2342h710H361114H212H3(H1924)
MFCD03352469
ZINC000002836685
ZINC02836685
ZINC2836685

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Available files

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