N-[[2-(diethylaminomethyl)phenyl]methyl]-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide

Systemtic Name: N-[[2-(diethylaminomethyl)phenyl]methyl]-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide Openeye Name: N-[[2-(diethylaminomethyl)phenyl]methyl]-2-[(5-methylisoxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide CAS Name: N-[[2-(diethylaminomethyl)phenyl]methyl]-2-[(5-methyl-3-isoxazolyl)methylthio]-3-pyridinecarboxamide IUPAC Name: N-[[2-(diethylaminomethyl)phenyl]methyl]-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide Traditional Name: N-[2-(diethylaminomethyl)benzyl]-2-[(5-methylisoxazol-3-yl)methylthio]nicotinamide Formula: C23H28N4O2S MolecularWeight: 424.55902

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=CC=C1CNC(=O)C2=C(N=CC=C2)SCC3=NOC(=C3)C

Isomeric SMILES

CCN(CC)CC1=CC=CC=C1CNC(=O)C2=C(N=CC=C2)SCC3=NOC(=C3)C

InChI

InChI=1S/C23H28N4O2S/c1-4-27(5-2)15-19-10-7-6-9-18(19)14-25-22(28)21-11-8-12-24-23(21)30-16-20-13-17(3)29-26-20/h6-13H,4-5,14-16H2,1-3H3,(H,25,28)