Vitas-M small molecule compound
6-[(4-iodophenyl)carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
Catalog ID
STK426264
SMILES O=C(C1CC(=C(CC1C(=O)O)C)C)Nc1ccc(cc1)I
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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 C16H18INO3 MW 399.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18INO3/c1-9-7-13(14(16(20)21)8-10(9)2)15(19)18-12-5-3-11(17)4-6-12/h3-6,13-14H,7-8H2,1-2H3,(H,18,19)(H,20,21)InChIKey
KTSLUZPORMHNPS-UHFFFAOYSA-NSynonyms
(1R6R)6((4IODOPHENYL)CARBAMOYL)34DIMETHYLCYCLOHEX3ENE1CARBOXYLICACID
(1R6S)6((4IODOPHENYL)CARBAMOYL)34DIMETHYLCYCLOHEX3ENE1CARBOXYLICACID
(1S6S)6((4IODOPHENYL)CARBAMOYL)34DIMETHYLCYCLOHEX3ENE1CARBOXYLICACID
6((4IODOANILINO)CARBONYL)34DIMETHYLCYCLOHEX3ENE1CARBOXYLICACID
6((4iodophenyl)carbamoyl)34dimethylcyclohex3ene1carboxylicacid
6(N(4IODOPHENYL)CARBAMOYL)34DIMETHYLCYCLOHEX3ENECARBOXYLICACID
CC1=C(CC(C(C1)C(=O)NC2=CC=C(C=C2)I)C(=O)O)C
InChI=1SC16H18INO3c19713(14(16(20)21)810(9)2)15(19)18125311(17)4612h361314H78H212H3(H1819)(H2021)
MFCD01570711
ZINC000004371572
ZINC000004371579
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