N-[4-[1-oxidanylidene-1-(pyridin-2-ylamino)propan-2-yl]sulfanylphenyl]cyclohexanecarboxamide

Systemtic Name: N-[4-[1-oxidanylidene-1-(pyridin-2-ylamino)propan-2-yl]sulfanylphenyl]cyclohexanecarboxamide Openeye Name: N-[4-[1-methyl-2-oxo-2-(2-pyridylamino)ethyl]sulfanylphenyl]cyclohexanecarboxamide CAS Name: N-[4-[[1-oxo-1-(2-pyridinylamino)propan-2-yl]thio]phenyl]cyclohexanecarboxamide IUPAC Name: N-[4-[1-oxo-1-(pyridin-2-ylamino)propan-2-yl]sulfanylphenyl]cyclohexanecarboxamide Traditional Name: N-[4-[[2-keto-1-methyl-2-(2-pyridylamino)ethyl]thio]phenyl]cyclohexanecarboxamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=N1)SC2=CC=C(C=C2)NC(=O)C3CCCCC3

Isomeric SMILES

CC(C(=O)NC1=CC=CC=N1)SC2=CC=C(C=C2)NC(=O)C3CCCCC3

InChI

InChI=1S/C21H25N3O2S/c1-15(20(25)24-19-9-5-6-14-22-19)27-18-12-10-17(11-13-18)23-21(26)16-7-3-2-4-8-16/h5-6,9-16H,2-4,7-8H2,1H3,(H,23,26)(H,22,24,25)