2-[2-(3-aminocarbonylphenyl)ethylsulfanyl]-N-cyclohexyl-pyridine-3-carboxamide

Systemtic Name: 2-[2-(3-aminocarbonylphenyl)ethylsulfanyl]-N-cyclohexyl-pyridine-3-carboxamide Openeye Name: 2-[2-(3-carbamoylphenyl)ethylsulfanyl]-N-cyclohexyl-pyridine-3-carboxamide CAS Name: 2-[2-(3-carbamoylphenyl)ethylthio]-N-cyclohexyl-3-pyridinecarboxamide IUPAC Name: 2-[2-(3-carbamoylphenyl)ethylsulfanyl]-N-cyclohexylpyridine-3-carboxamide Traditional Name: 2-[2-(3-carbamoylphenyl)ethylthio]-N-cyclohexyl-nicotinamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=C(N=CC=C2)SCCC3=CC=CC(=C3)C(=O)N

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=C(N=CC=C2)SCCC3=CC=CC(=C3)C(=O)N

InChI

InChI=1S/C21H25N3O2S/c22-19(25)16-7-4-6-15(14-16)11-13-27-21-18(10-5-12-23-21)20(26)24-17-8-2-1-3-9-17/h4-7,10,12,14,17H,1-3,8-9,11,13H2,(H2,22,25)(H,24,26)