Vitas-M small molecule compound

ethyl 4-{[(4-phenylbutyl)carbamothioyl]amino}benzoate

Catalog ID
STK456377
SMILES CCOC(=O)c1ccc(cc1)NC(=S)NCCCCc1ccccc1

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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 C20H24N2O2S MW 356.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N2O2S/c1-2-24-19(23)17-11-13-18(14-12-17)22-20(25)21-15-7-6-10-16-8-4-3-5-9-16/h3-5,8-9,11-14H,2,6-7,10,15H2,1H3,(H2,21,22,25)
InChIKey
MQRQCTOASHUVSU-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)NC(=S)NCCCCC2=CC=CC=C2
ETHYL4((((4PHENYLBUTYL)AMINO)THIOXOMETHYL)AMINO)BENZOATE
ethyl4(((4phenylbutyl)carbamothioyl)amino)benzoate
ETHYL4(4PHENYLBUTYLCARBAMOTHIOYLAMINO)BENZOATE
InChI=1SC20H24N2O2Sc122419(23)17111318(141217)2220(25)21157610168435916h35891114H2671015H21H3(H2212225)
MFCD04286532
ZINC000002854670
ZINC02854670
ZINC2854670

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Available files

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