2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-N-[(4-piperidin-1-ylcarbonylphenyl)methyl]ethanamide

Systemtic Name: 2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-N-[(4-piperidin-1-ylcarbonylphenyl)methyl]ethanamide Openeye Name: 2-[(5-acetyl-2-methoxy-phenyl)methylsulfanyl]-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]acetamide CAS Name: 2-[(5-acetyl-2-methoxyphenyl)methylthio]-N-[[4-[oxo(1-piperidinyl)methyl]phenyl]methyl]acetamide IUPAC Name: 2-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]acetamide Traditional Name: 2-[(5-acetyl-2-methoxy-benzyl)thio]-N-[4-(piperidine-1-carbonyl)benzyl]acetamide Formula: C25H30N2O4S MolecularWeight: 454.5817

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSCC(=O)NCC2=CC=C(C=C2)C(=O)N3CCCCC3

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSCC(=O)NCC2=CC=C(C=C2)C(=O)N3CCCCC3

InChI

InChI=1S/C25H30N2O4S/c1-18(28)21-10-11-23(31-2)22(14-21)16-32-17-24(29)26-15-19-6-8-20(9-7-19)25(30)27-12-4-3-5-13-27/h6-11,14H,3-5,12-13,15-17H2,1-2H3,(H,26,29)