2,2-dimethyl-N-[1-oxidanylidene-1-[[4-(pyridin-3-ylmethylsulfanyl)phenyl]amino]propan-2-yl]propanamide

Systemtic Name: 2,2-dimethyl-N-[1-oxidanylidene-1-[[4-(pyridin-3-ylmethylsulfanyl)phenyl]amino]propan-2-yl]propanamide Openeye Name: 2,2-dimethyl-N-[1-methyl-2-oxo-2-[4-(3-pyridylmethylsulfanyl)anilino]ethyl]propanamide CAS Name: 2,2-dimethyl-N-[1-oxo-1-[4-(3-pyridinylmethylthio)anilino]propan-2-yl]propanamide IUPAC Name: 2,2-dimethyl-N-[1-oxo-1-[4-(pyridin-3-ylmethylsulfanyl)anilino]propan-2-yl]propanamide Traditional Name: N-[2-keto-1-methyl-2-[4-(3-pyridylmethylthio)anilino]ethyl]-2,2-dimethyl-propionamide Formula: C20H25N3O2S MolecularWeight: 371.4964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)SCC2=CN=CC=C2)NC(=O)C(C)(C)C

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)SCC2=CN=CC=C2)NC(=O)C(C)(C)C

InChI

InChI=1S/C20H25N3O2S/c1-14(22-19(25)20(2,3)4)18(24)23-16-7-9-17(10-8-16)26-13-15-6-5-11-21-12-15/h5-12,14H,13H2,1-4H3,(H,22,25)(H,23,24)