N-methyl-N-[(4-methylsulfanylphenyl)methyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide

Systemtic Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide CAS Name: N-methyl-N-[[4-(methylthio)phenyl]methyl]-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-methyl-N-[4-(methylthio)benzyl]-1-[(E)-3-phenylacryloyl]isonipecotamide Formula: C24H28N2O2S MolecularWeight: 408.55632

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)SC)C(=O)C2CCN(CC2)C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CN(CC1=CC=C(C=C1)SC)C(=O)C2CCN(CC2)C(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C24H28N2O2S/c1-25(18-20-8-11-22(29-2)12-9-20)24(28)21-14-16-26(17-15-21)23(27)13-10-19-6-4-3-5-7-19/h3-13,21H,14-18H2,1-2H3/b13-10+