N-[(4-cyanophenyl)methyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridine-3-carboxamide

Systemtic Name: N-[(4-cyanophenyl)methyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridine-3-carboxamide Openeye Name: N-[(4-cyanophenyl)methyl]-2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]pyridine-3-carboxamide CAS Name: N-[(4-cyanophenyl)methyl]-2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-3-pyridinecarboxamide IUPAC Name: N-[(4-cyanophenyl)methyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridine-3-carboxamide Traditional Name: N-(4-cyanobenzyl)-2-[(3,5-dimethylisoxazol-4-yl)methylthio]nicotinamide Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)NCC3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)NCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H18N4O2S/c1-13-18(14(2)26-24-13)12-27-20-17(4-3-9-22-20)19(25)23-11-16-7-5-15(10-21)6-8-16/h3-9H,11-12H2,1-2H3,(H,23,25)