Molecular Formula:
C22H28N2O3S
InChI: InChI=1/C22H28N2O3S/c1-4-22(2,3)13-9-10-14-17(12-23)20(28-18(14)11-13)24-19(25)15-7-5-6-8-16(15)21(26)27/h5-6,13,15-16H,4,7-11H2,1-3H3,(H,24,25)(H,26,27)/f/h24,26H
InChIKey: InChIKey=AORQVCVHMJZNIX-PWIKPTQSCA
SMILES: CCC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=O)C3CC=CCC3C(=O)O
Names:
6-[[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid
Registries:
PubChem CID 3609302
PubChem ID 9763594