Vitas-M small molecule compound
6-{[3-carbamoyl-5-methyl-4-(4-methylphenyl)thiophen-2-yl]carbamoyl}-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
Catalog ID
STK471658
SMILES Cc1ccc(cc1)c1c(C)sc(c1C(=O)N)NC(=O)C1CC(=C(CC1C(=O)O)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 C23H26N2O4S MW 426.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N2O4S/c1-11-5-7-15(8-6-11)18-14(4)30-22(19(18)20(24)26)25-21(27)16-9-12(2)13(3)10-17(16)23(28)29/h5-8,16-17H,9-10H2,1-4H3,(H2,24,26)(H,25,27)(H,28,29)InChIKey
YQNYWMKSKJFNQS-UHFFFAOYSA-NSynonyms
6((3carbamoyl5methyl4(4methylphenyl)thiophen2yl)carbamoyl)34dimethylcyclohex3ene1carboxylicacid
6(N(3CARBAMOYL5METHYL4(4METHYLPHENYL)(2THIENYL))CARBAMOYL)34DIMETHYLCYCLOHEX3ENECARBOXYLICACID
CC1=C(CC(C(C1)C(=O)NC2=C(C(=C(S2)C)C3=CC=C(C=C3)C)C(=O)N)C(=O)O)C
InChI=1SC23H26N2O4Sc1115715(8611)1814(4)3022(19(18)20(24)26)2521(27)16912(2)13(3)1017(16)23(28)29h581617H910H214H3(H22426)(H2527)(H2829)
MFCD06030806
ZINC000017094946
ZINC000017094949
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