Vitas-M small molecule compound
ethyl 4-{[(1,3-benzodioxol-5-ylmethyl)carbamothioyl]amino}benzoate
Catalog ID
STK868452
SMILES CCOC(=O)c1ccc(cc1)NC(=S)NCc1ccc2c(c1)OCO2
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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 C18H18N2O4S MW 358.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O4S/c1-2-22-17(21)13-4-6-14(7-5-13)20-18(25)19-10-12-3-8-15-16(9-12)24-11-23-15/h3-9H,2,10-11H2,1H3,(H2,19,20,25)InChIKey
KZMAYXCHEOEXFX-UHFFFAOYSA-NSynonyms
4(3BENZO(13)DIOXOL5YLMETHYLTHIOUREIDO)BENZOICACIDETHYLESTER
CCOC(=O)C1=CC=C(C=C1)NC(=S)NCC2=CC3=C(C=C2)OCO3
ethyl4(((13benzodioxol5ylmethyl)carbamothioyl)amino)benzoate
ETHYL4(13BENZODIOXOL5YLMETHYLCARBAMOTHIOYLAMINO)BENZOATE
ethyl4(3(benzo(d)(13)dioxol5ylmethyl)thioureido)benzoate
InChI=1SC18H18N2O4Sc122217(21)134614(7513)2018(25)191012381516(912)24112315h39H21011H21H3(H2192025)
MFCD02139818
ZINC000001176107
ZINC01176107
ZINC1176107
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