O-[2-[[1-(3-methylbutyl)cyclohexyl]carbonylamino]phenyl] pyridine-3-carbothioate

Systemtic Name: O-[2-[[1-(3-methylbutyl)cyclohexyl]carbonylamino]phenyl] pyridine-3-carbothioate Openeye Name: O-[2-[(1-isopentylcyclohexanecarbonyl)amino]phenyl] pyridine-3-carbothioate CAS Name: 3-pyridinecarbothioic acid O-[2-[[[1-(3-methylbutyl)cyclohexyl]-oxomethyl]amino]phenyl] ester IUPAC Name: O-[2-[[1-(3-methylbutyl)cyclohexanecarbonyl]amino]phenyl] pyridine-3-carbothioate Traditional Name: pyridine-3-carbothioic acid O-[2-[(1-isoamylcyclohexanecarbonyl)amino]phenyl] ester Formula: C24H30N2O2S MolecularWeight: 410.5722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1(CCCCC1)C(=O)NC2=CC=CC=C2OC(=S)C3=CN=CC=C3

Isomeric SMILES

CC(C)CCC1(CCCCC1)C(=O)NC2=CC=CC=C2OC(=S)C3=CN=CC=C3

InChI

InChI=1S/C24H30N2O2S/c1-18(2)12-15-24(13-6-3-7-14-24)23(27)26-20-10-4-5-11-21(20)28-22(29)19-9-8-16-25-17-19/h4-5,8-11,16-18H,3,6-7,12-15H2,1-2H3,(H,26,27)