2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-N-[(4-piperidin-1-ylcarbonylphenyl)methyl]benzamide

Systemtic Name: 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-N-[(4-piperidin-1-ylcarbonylphenyl)methyl]benzamide Openeye Name: 2-[(5-methylisoxazol-3-yl)methylsulfanyl]-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]benzamide CAS Name: 2-[(5-methyl-3-isoxazolyl)methylthio]-N-[[4-[oxo(1-piperidinyl)methyl]phenyl]methyl]benzamide IUPAC Name: 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]benzamide Traditional Name: 2-[(5-methylisoxazol-3-yl)methylthio]-N-[4-(piperidine-1-carbonyl)benzyl]benzamide Formula: C25H27N3O3S MolecularWeight: 449.56518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CSC2=CC=CC=C2C(=O)NCC3=CC=C(C=C3)C(=O)N4CCCCC4

Isomeric SMILES

CC1=CC(=NO1)CSC2=CC=CC=C2C(=O)NCC3=CC=C(C=C3)C(=O)N4CCCCC4

InChI

InChI=1S/C25H27N3O3S/c1-18-15-21(27-31-18)17-32-23-8-4-3-7-22(23)24(29)26-16-19-9-11-20(12-10-19)25(30)28-13-5-2-6-14-28/h3-4,7-12,15H,2,5-6,13-14,16-17H2,1H3,(H,26,29)