Vitas-M small molecule compound
3-[(butan-2-ylcarbamoyl)amino]-4-methylbenzoic acid
Catalog ID
STK489156
SMILES Cc1ccc(cc1NC(=O)NC(CC)C)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 C13H18N2O3 MW 250.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H18N2O3/c1-4-9(3)14-13(18)15-11-7-10(12(16)17)6-5-8(11)2/h5-7,9H,4H2,1-3H3,(H,16,17)(H2,14,15,18)InChIKey
XCQFWUWEXRYDDM-UHFFFAOYSA-NSynonyms
3((butan2ylcarbamoyl)amino)4methylbenzoicacid
3(butan2ylcarbamoylamino)4methylbenzoicacid
4METHYL3(((METHYLPROPYL)AMINO)CARBONYLAMINO)BENZOICACID
CCC(C)NC(=O)NC1=C(C=CC(=C1)C(=O)O)C
InChI=1SC13H18N2O3c149(3)1413(18)1511710(12(16)17)658(11)2h579H4H213H3(H1617)(H2141518)
MFCD09451936
ZINC000013746311
ZINC000013746313
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