N-[(3-methyl-1-benzothiophen-2-yl)methyl]-4-phenyl-1-(3-phenylpropanoyl)piperidine-4-carboxamide

Systemtic Name: N-[(3-methyl-1-benzothiophen-2-yl)methyl]-4-phenyl-1-(3-phenylpropanoyl)piperidine-4-carboxamide Openeye Name: N-[(3-methylbenzothiophen-2-yl)methyl]-4-phenyl-1-(3-phenylpropanoyl)piperidine-4-carboxamide CAS Name: N-[(3-methyl-1-benzothiophen-2-yl)methyl]-1-(1-oxo-3-phenylpropyl)-4-phenyl-4-piperidinecarboxamide IUPAC Name: N-[(3-methyl-1-benzothiophen-2-yl)methyl]-4-phenyl-1-(3-phenylpropanoyl)piperidine-4-carboxamide Traditional Name: 1-hydrocinnamoyl-N-[(3-methylbenzothiophen-2-yl)methyl]-4-phenyl-isonipecotamide Formula: C31H32N2O2S MolecularWeight: 496.66298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)CNC(=O)C3(CCN(CC3)C(=O)CCC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)CNC(=O)C3(CCN(CC3)C(=O)CCC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H32N2O2S/c1-23-26-14-8-9-15-27(26)36-28(23)22-32-30(35)31(25-12-6-3-7-13-25)18-20-33(21-19-31)29(34)17-16-24-10-4-2-5-11-24/h2-15H,16-22H2,1H3,(H,32,35)