N-[2-(cyclohexen-1-yl)ethyl]-2-[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl]sulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl]sulfanyl-pyridine-3-carboxamide Openeye Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[2-(4-isopropylanilino)-2-oxo-ethyl]sulfanyl-pyridine-3-carboxamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-2-[[2-oxo-2-(4-propan-2-ylanilino)ethyl]thio]-3-pyridinecarboxamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[2-oxo-2-(4-propan-2-ylanilino)ethyl]sulfanylpyridine-3-carboxamide Traditional Name: 2-[(2-cumidino-2-keto-ethyl)thio]-N-[2-(cyclohexen-1-yl)ethyl]nicotinamide Formula: C25H31N3O2S MolecularWeight: 437.59754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)CSC2=C(C=CC=N2)C(=O)NCCC3=CCCCC3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)CSC2=C(C=CC=N2)C(=O)NCCC3=CCCCC3

InChI

InChI=1S/C25H31N3O2S/c1-18(2)20-10-12-21(13-11-20)28-23(29)17-31-25-22(9-6-15-27-25)24(30)26-16-14-19-7-4-3-5-8-19/h6-7,9-13,15,18H,3-5,8,14,16-17H2,1-2H3,(H,26,30)(H,28,29)