Vitas-M small molecule compound
3,4-dimethyl-6-({4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}carbamoyl)cyclohex-3-ene-1-carboxylic acid
Catalog ID
STK425321
SMILES CC(Cc1ccc(cc1)c1csc(n1)NC(=O)C1CC(=C(CC1C(=O)O)C)C)C
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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 C23H28N2O3S MW 412.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N2O3S/c1-13(2)9-16-5-7-17(8-6-16)20-12-29-23(24-20)25-21(26)18-10-14(3)15(4)11-19(18)22(27)28/h5-8,12-13,18-19H,9-11H2,1-4H3,(H,27,28)(H,24,25,26)InChIKey
AWGIWJVRRDWYKM-UHFFFAOYSA-NSynonyms
34dimethyl6((4(4(2methylpropyl)phenyl)13thiazol2yl)carbamoyl)cyclohex3ene1carboxylicacid
34DIMETHYL6(N(4(4(2METHYLPROPYL)PHENYL)(13THIAZOL2YL))CARBAMOYL)CYCLOHEX3ENECARBOXYLICACID
6(((4(4ISOBUTYLPHENYL)13THIAZOL2YL)AMINO)CARBONYL)34DIMETHYL3CYCLOHEXENE1CARBOXYLICACID
CC1=C(CC(C(C1)C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)CC(C)C)C(=O)O)C
InChI=1SC23H28N2O3Sc113(2)9165717(8616)20122923(2420)2521(26)181014(3)15(4)1119(18)22(27)28h5812131819H911H214H3(H2728)(H242526)
MFCD02375252
ZINC000004651435
ZINC000004651440
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