S-[2-[[1-(3-methylbutyl)cyclohexyl]carbonylamino]phenyl] 2-acetamido-5-azanyl-5-oxidanylidene-pentanethioate

Systemtic Name: S-[2-[[1-(3-methylbutyl)cyclohexyl]carbonylamino]phenyl] 2-acetamido-5-azanyl-5-oxidanylidene-pentanethioate Openeye Name: S-[2-[(1-isopentylcyclohexanecarbonyl)amino]phenyl] 2-acetamido-5-amino-5-oxo-pentanethioate CAS Name: 2-acetamido-5-amino-5-oxopentanethioic acid S-[2-[[[1-(3-methylbutyl)cyclohexyl]-oxomethyl]amino]phenyl] ester IUPAC Name: S-[2-[[1-(3-methylbutyl)cyclohexanecarbonyl]amino]phenyl] 2-acetamido-5-amino-5-oxopentanethioate Traditional Name: 2-acetamido-5-amino-5-keto-pentanethioic acid S-[2-[(1-isoamylcyclohexanecarbonyl)amino]phenyl] ester Formula: C25H37N3O4S MolecularWeight: 475.64398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1(CCCCC1)C(=O)NC2=CC=CC=C2SC(=O)C(CCC(=O)N)NC(=O)C

Isomeric SMILES

CC(C)CCC1(CCCCC1)C(=O)NC2=CC=CC=C2SC(=O)C(CCC(=O)N)NC(=O)C

InChI

InChI=1S/C25H37N3O4S/c1-17(2)13-16-25(14-7-4-8-15-25)24(32)28-19-9-5-6-10-21(19)33-23(31)20(27-18(3)29)11-12-22(26)30/h5-6,9-10,17,20H,4,7-8,11-16H2,1-3H3,(H2,26,30)(H,27,29)(H,28,32)