Vitas-M small molecule compound

ethyl 4-({[1-(bicyclo[2.2.1]hept-2-yl)ethyl]carbamothioyl}amino)benzoate

Catalog ID
STK493709
SMILES CCOC(=O)c1ccc(cc1)NC(=S)NC(C1CC2CC1CC2)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 C19H26N2O2S MW 346.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H26N2O2S/c1-3-23-18(22)14-6-8-16(9-7-14)21-19(24)20-12(2)17-11-13-4-5-15(17)10-13/h6-9,12-13,15,17H,3-5,10-11H2,1-2H3,(H2,20,21,24)
InChIKey
DTNBVIFWFWESCQ-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC(C)C2CC3CCC2C3
ETHYL4((((BICYCLO(221)HEPT2YLETHYL)AMINO)THIOXOMETHYL)AMINO)BENZOATE
ethyl4(((1(bicyclo(221)hept2yl)ethyl)carbamothioyl)amino)benzoate
ethyl4(1(3bicyclo(221)heptanyl)ethylcarbamothioylamino)benzoate
InChI=1SC19H26N2O2Sc132318(22)146816(9714)2119(24)2012(2)1711134515(17)1013h6912131517H351011H212H3(H2202124)
MFCD06145175
ZINC000102837446
ZINC000102837452

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Available files

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