Vitas-M small molecule compound

4-methoxy-N-{2,2,2-trichloro-1-[(quinolin-8-ylcarbamothioyl)amino]ethyl}benzamide

Catalog ID
STK369619
SMILES COc1ccc(cc1)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)Nc1cccc2c1nccc2

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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 C20H17Cl3N4O2S MW 483.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17Cl3N4O2S/c1-29-14-9-7-13(8-10-14)17(28)26-18(20(21,22)23)27-19(30)25-15-6-2-4-12-5-3-11-24-16(12)15/h2-11,18H,1H3,(H,26,28)(H2,25,27,30)
InChIKey
FKCUXVABQKXXTA-UHFFFAOYSA-N
Synonyms

4methoxyN(222trichloro1((quinolin8ylcarbamothioyl)amino)ethyl)benzamide
4METHOXYN(222TRICHLORO1(3QUINOLIN8YLTHIOUREIDO)ETHYL)BENZAMIDE
4METHOXYN(222TRICHLORO1(QUINOLIN8YLCARBAMOTHIOYLAMINO)ETHYL)BENZAMIDE
COC1=CC=C(C=C1)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=CC=CC3=C2N=CC=C3
InChI=1SC20H17Cl3N4O2Sc129149713(81014)17(28)2618(20(2122)23)2719(30)25156241253112416(12)15h21118H1H3(H2628)(H2252730)
MFCD00340372
ZINC000000850602
ZINC000002688076

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Available files

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