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

Systemtic Name: N-[3-(cyclopropylcarbamoyl)phenyl]-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide Openeye Name: N-[3-(cyclopropylcarbamoyl)phenyl]-2-[(5-methylisoxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide CAS Name: N-[3-[(cyclopropylamino)-oxomethyl]phenyl]-2-[(5-methyl-3-isoxazolyl)methylthio]-3-pyridinecarboxamide IUPAC Name: N-[3-(cyclopropylcarbamoyl)phenyl]-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide Traditional Name: N-[3-(cyclopropylcarbamoyl)phenyl]-2-[(5-methylisoxazol-3-yl)methylthio]nicotinamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CSC2=C(C=CC=N2)C(=O)NC3=CC=CC(=C3)C(=O)NC4CC4

Isomeric SMILES

CC1=CC(=NO1)CSC2=C(C=CC=N2)C(=O)NC3=CC=CC(=C3)C(=O)NC4CC4

InChI

InChI=1S/C21H20N4O3S/c1-13-10-17(25-28-13)12-29-21-18(6-3-9-22-21)20(27)24-16-5-2-4-14(11-16)19(26)23-15-7-8-15/h2-6,9-11,15H,7-8,12H2,1H3,(H,23,26)(H,24,27)