2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]-N-methyl-N-[(2-piperidin-1-ylphenyl)methyl]ethanamide

Systemtic Name: 2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]-N-methyl-N-[(2-piperidin-1-ylphenyl)methyl]ethanamide Openeye Name: 2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]-N-methyl-N-[[2-(1-piperidyl)phenyl]methyl]acetamide CAS Name: 2-[(4-methoxy-3-nitrophenyl)methylthio]-N-methyl-N-[[2-(1-piperidinyl)phenyl]methyl]acetamide IUPAC Name: 2-[(4-methoxy-3-nitrophenyl)methylsulfanyl]-N-methyl-N-[(2-piperidin-1-ylphenyl)methyl]acetamide Traditional Name: 2-[(4-methoxy-3-nitro-benzyl)thio]-N-methyl-N-(2-piperidinobenzyl)acetamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1N2CCCCC2)C(=O)CSCC3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=CC=C1N2CCCCC2)C(=O)CSCC3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C23H29N3O4S/c1-24(15-19-8-4-5-9-20(19)25-12-6-3-7-13-25)23(27)17-31-16-18-10-11-22(30-2)21(14-18)26(28)29/h4-5,8-11,14H,3,6-7,12-13,15-17H2,1-2H3