Vitas-M small molecule compound

2-chloro-4-({[(3-methoxynaphthalen-2-yl)carbonyl]carbamothioyl}amino)benzoic acid

Catalog ID
STK184712
SMILES COc1cc2ccccc2cc1C(=O)NC(=S)Nc1ccc(c(c1)Cl)C(=O)O

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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 C20H15ClN2O4S MW 414.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15ClN2O4S/c1-27-17-9-12-5-3-2-4-11(12)8-15(17)18(24)23-20(28)22-13-6-7-14(19(25)26)16(21)10-13/h2-10H,1H3,(H,25,26)(H2,22,23,24,28)
InChIKey
FJRUZADTHGXIPL-UHFFFAOYSA-N
Synonyms

2CHLORO4((((3METHOXYNAPHTHALEN2YL)CARBONYL)CARBAMOTHIOYL)AMINO)BENZOICACID
2CHLORO4((3METHOXYNAPHTHALENE2CARBONYL)CARBAMOTHIOYLAMINO)BENZOICACID
COC1=CC2=CC=CC=C2C=C1C(=O)NC(=S)NC3=CC(=C(C=C3)C(=O)O)Cl
InChI=1SC20H15ClN2O4Sc12717912532411(12)815(17)18(24)2320(28)22136714(19(25)26)16(21)1013h210H1H3(H2526)(H222232428)
MFCD04209033
ZINC000001159923
ZINC1159923

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Available files

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