(3-cyano-6-tert-butyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)carbamoylmethyl 4-nitrobenzoate

Molecular Formula: C22H23N3O5S


InChI: InChI=1/C22H23N3O5S/c1-22(2,3)14-6-9-16-17(11-23)20(31-18(16)10-14)24-19(26)12-30-21(27)13-4-7-15(8-5-13)25(28)29/h4-5,7-8,14H,6,9-10,12H2,1-3H3,(H,24,26)/f/h24H

InChIKey: InChIKey=KBIPGDKPXMUJTH-LQFNOIFHCY
SMILES: CC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=O)COC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Names:
    (3-cyano-6-tert-butyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)carbamoylmethyl 4-nitrobenzoate

Registries:
    PubChem CID 3600797
    PubChem ID 9760894