Vitas-M small molecule compound

2-chloro-4-{[(naphthalen-1-ylcarbonyl)carbamothioyl]amino}benzoic acid

Catalog ID
STK093436
SMILES S=C(NC(=O)c1cccc2c1cccc2)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 C19H13ClN2O3S MW 384.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13ClN2O3S/c20-16-10-12(8-9-15(16)18(24)25)21-19(26)22-17(23)14-7-3-5-11-4-1-2-6-13(11)14/h1-10H,(H,24,25)(H2,21,22,23,26)
InChIKey
QPAOIWZZEXSWJA-UHFFFAOYSA-N
Synonyms
531545-68-3
2CHLORO4(((NAPHTHALEN1YLCARBONYL)CARBAMOTHIOYL)AMINO)BENZOICACID
2CHLORO4(NAPHTHALENE1CARBONYLCARBAMOTHIOYLAMINO)BENZOICACID
531545683
C1=CC=C2C(=C1)C=CC=C2C(=O)NC(=S)NC3=CC(=C(C=C3)C(=O)O)Cl
InChI=1SC19H13ClN2O3Sc20161012(8915(16)18(24)25)2119(26)2217(23)1473511412613(11)14h110H(H2425)(H221222326)
MFCD03453776
S=C(NC(=O)c1cccc2c1cccc2)Nc1ccc(c(c1)Cl)C(=O)O
STK093436
ZINC000004675250
ZINC4675250

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Available files

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