Vitas-M small molecule compound

ethyl 4-({[(5-chloronaphthalen-1-yl)carbonyl]carbamothioyl}amino)benzoate

Catalog ID
STK344850
SMILES CCOC(=O)c1ccc(cc1)NC(=S)NC(=O)c1cccc2c1cccc2Cl

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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 C21H17ClN2O3S MW 412.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN2O3S/c1-2-27-20(26)13-9-11-14(12-10-13)23-21(28)24-19(25)17-7-3-6-16-15(17)5-4-8-18(16)22/h3-12H,2H2,1H3,(H2,23,24,25,28)
InChIKey
ZSYYKMLEYPTIEN-UHFFFAOYSA-N
Synonyms

4(3(5CHLORONAPHTHALENE1CARBONYL)THIOUREIDO)BENZOICACIDETHYLESTER
CCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC3=C2C=CC=C3Cl
ethyl4((((5chloronaphthalen1yl)carbonyl)carbamothioyl)amino)benzoate
ETHYL4((5CHLORONAPHTHALENE1CARBONYL)CARBAMOTHIOYLAMINO)BENZOATE
InChI=1SC21H17ClN2O3Sc122720(26)1391114(121013)2321(28)2419(25)177361615(17)54818(16)22h312H2H21H3(H223242528)
MFCD05848449
ZINC000004820448
ZINC04820448
ZINC4820448

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Available files

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