Vitas-M small molecule compound

4-({[(4-butoxyphenyl)carbonyl]carbamothioyl}amino)-2-chlorobenzoic acid

Catalog ID
STK011262
SMILES CCCCOc1ccc(cc1)C(=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 C19H19ClN2O4S MW 406.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClN2O4S/c1-2-3-10-26-14-7-4-12(5-8-14)17(23)22-19(27)21-13-6-9-15(18(24)25)16(20)11-13/h4-9,11H,2-3,10H2,1H3,(H,24,25)(H2,21,22,23,27)
InChIKey
MDUJORSIJGFZCM-UHFFFAOYSA-N
Synonyms
433945-74-5
4((((4BUTOXYPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)2CHLOROBENZOICACID
4(((4BUTOXYBENZOYL)CARBAMOTHIOYL)AMINO)2CHLOROBENZOICACID
4((4BUTOXYBENZOYL)CARBAMOTHIOYLAMINO)2CHLOROBENZOICACID
4(3(4butoxybenzoyl)thioureido)2chlorobenzoicacid
433945745
CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)C(=O)O)Cl
CCCCOc1ccc(cc1)C(=O)NC(=S)Nc1ccc(c(c1)Cl)C(=O)O
InChI=1SC19H19ClN2O4Sc1231026147412(5814)17(23)2219(27)21136915(18(24)25)16(20)1113h4911H2310H21H3(H2425)(H221222327)
MFCD03453807
STK011262
ZINC000002238406
ZINC2238406

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Available files

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