N-[[4-(diethylaminomethyl)phenyl]methyl]-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide

Systemtic Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide Openeye Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide CAS Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-1-[oxo(thiophen-2-yl)methyl]-3-piperidinecarboxamide IUPAC Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide Traditional Name: N-[4-(diethylaminomethyl)benzyl]-1-(2-thenoyl)nipecotamide Formula: C23H31N3O2S MolecularWeight: 413.57614

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)C(=O)C3=CC=CS3

Isomeric SMILES

CCN(CC)CC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)C(=O)C3=CC=CS3

InChI

InChI=1S/C23H31N3O2S/c1-3-25(4-2)16-19-11-9-18(10-12-19)15-24-22(27)20-7-5-13-26(17-20)23(28)21-8-6-14-29-21/h6,8-12,14,20H,3-5,7,13,15-17H2,1-2H3,(H,24,27)