Vitas-M small molecule compound
3,4-dimethyl-6-({4-[(pyridin-3-ylmethyl)carbamoyl]phenyl}carbamoyl)cyclohex-3-ene-1-carboxylic acid
Catalog ID
STK330338
SMILES O=C(c1ccc(cc1)NC(=O)C1CC(=C(CC1C(=O)O)C)C)NCc1cccnc1
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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 C23H25N3O4 MW 407.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N3O4/c1-14-10-19(20(23(29)30)11-15(14)2)22(28)26-18-7-5-17(6-8-18)21(27)25-13-16-4-3-9-24-12-16/h3-9,12,19-20H,10-11,13H2,1-2H3,(H,25,27)(H,26,28)(H,29,30)InChIKey
ILIGCSVGXRKHMZ-UHFFFAOYSA-NSynonyms
34dimethyl6((4((pyridin3ylmethyl)carbamoyl)phenyl)carbamoyl)cyclohex3ene1carboxylicacid
34DIMETHYL6((4(PYRIDIN3YLMETHYLCARBAMOYL)PHENYL)CARBAMOYL)CYCLOHEX3ENE1CARBOXYLICACID
CC1=C(CC(C(C1)C(=O)NC2=CC=C(C=C2)C(=O)NCC3=CN=CC=C3)C(=O)O)C
InChI=1SC23H25N3O4c1141019(20(23(29)30)1115(14)2)22(28)26187517(6818)21(27)251316439241216h39121920H101113H212H3(H2527)(H2628)(H2930)
MFCD02153182
ZINC000004994034
ZINC000004994037
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