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

Systemtic Name: 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-N-(3-phenylmethoxypropyl)pyridine-3-carboxamide Openeye Name: N-(3-benzyloxypropyl)-2-[(5-methylisoxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide CAS Name: 2-[(5-methyl-3-isoxazolyl)methylthio]-N-(3-phenylmethoxypropyl)-3-pyridinecarboxamide IUPAC Name: 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-N-(3-phenylmethoxypropyl)pyridine-3-carboxamide Traditional Name: N-(3-benzoxypropyl)-2-[(5-methylisoxazol-3-yl)methylthio]nicotinamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CSC2=C(C=CC=N2)C(=O)NCCCOCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=NO1)CSC2=C(C=CC=N2)C(=O)NCCCOCC3=CC=CC=C3

InChI

InChI=1S/C21H23N3O3S/c1-16-13-18(24-27-16)15-28-21-19(9-5-10-23-21)20(25)22-11-6-12-26-14-17-7-3-2-4-8-17/h2-5,7-10,13H,6,11-12,14-15H2,1H3,(H,22,25)