Vitas-M small molecule compound

ethyl 4-({[(3-propoxyphenyl)carbonyl]carbamothioyl}amino)benzoate

Catalog ID
STK141228
SMILES CCCOc1cccc(c1)C(=O)NC(=S)Nc1ccc(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 C20H22N2O4S MW 386.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O4S/c1-3-12-26-17-7-5-6-15(13-17)18(23)22-20(27)21-16-10-8-14(9-11-16)19(24)25-4-2/h5-11,13H,3-4,12H2,1-2H3,(H2,21,22,23,27)
InChIKey
OLOPOXWMVRREKX-UHFFFAOYSA-N
Synonyms

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)OCC
ETHYL4((((3PROPOXYBENZOYL)AMINO)CARBOTHIOYL)AMINO)BENZOATE
ETHYL4((((3PROPOXYPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)BENZOATE
ETHYL4((3PROPOXYBENZOYL)CARBAMOTHIOYLAMINO)BENZOATE
InChI=1SC20H22N2O4Sc1312261775615(1317)18(23)2220(27)211610814(91116)19(24)2542h51113H3412H212H3(H221222327)
MFCD02631681
ZINC000002053757
ZINC02053757
ZINC2053757

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Available files

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