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

Systemtic Name: 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-N-[[4-(2-methylpropanoylamino)phenyl]methyl]pyridine-3-carboxamide Openeye Name: 2-[(5-methylisoxazol-3-yl)methylsulfanyl]-N-[[4-(2-methylpropanoylamino)phenyl]methyl]pyridine-3-carboxamide CAS Name: 2-[(5-methyl-3-isoxazolyl)methylthio]-N-[[4-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-N-[[4-(2-methylpropanoylamino)phenyl]methyl]pyridine-3-carboxamide Traditional Name: N-[4-(isobutyrylamino)benzyl]-2-[(5-methylisoxazol-3-yl)methylthio]nicotinamide Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O3S/c1-14(2)20(27)25-17-8-6-16(7-9-17)12-24-21(28)19-5-4-10-23-22(19)30-13-18-11-15(3)29-26-18/h4-11,14H,12-13H2,1-3H3,(H,24,28)(H,25,27)