3-[2-(2-cyclohexylethanoylamino)ethylsulfanylmethyl]-N,N-dimethyl-4-oxidanylidene-4-pyridin-3-yl-butanamide

Systemtic Name: 3-[2-(2-cyclohexylethanoylamino)ethylsulfanylmethyl]-N,N-dimethyl-4-oxidanylidene-4-pyridin-3-yl-butanamide Openeye Name: 3-[2-[(2-cyclohexylacetyl)amino]ethylsulfanylmethyl]-N,N-dimethyl-4-oxo-4-(3-pyridyl)butanamide CAS Name: 3-[[2-[(2-cyclohexyl-1-oxoethyl)amino]ethylthio]methyl]-N,N-dimethyl-4-oxo-4-(3-pyridinyl)butanamide IUPAC Name: 3-[2-[(2-cyclohexylacetyl)amino]ethylsulfanylmethyl]-N,N-dimethyl-4-oxo-4-pyridin-3-ylbutanamide Traditional Name: 3-[[2-[(2-cyclohexylacetyl)amino]ethylthio]methyl]-4-keto-N,N-dimethyl-4-(3-pyridyl)butyramide Formula: C22H33N3O3S MolecularWeight: 419.58072

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CC(CSCCNC(=O)CC1CCCCC1)C(=O)C2=CN=CC=C2

Isomeric SMILES

CN(C)C(=O)CC(CSCCNC(=O)CC1CCCCC1)C(=O)C2=CN=CC=C2

InChI

InChI=1S/C22H33N3O3S/c1-25(2)21(27)14-19(22(28)18-9-6-10-23-15-18)16-29-12-11-24-20(26)13-17-7-4-3-5-8-17/h6,9-10,15,17,19H,3-5,7-8,11-14,16H2,1-2H3,(H,24,26)