N-[(4-dimethylaminophenyl)methyl]-1-(5-indol-1-ylthiophen-2-yl)carbonyl-piperidine-3-carboxamide

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-1-(5-indol-1-ylthiophen-2-yl)carbonyl-piperidine-3-carboxamide Openeye Name: N-[(4-dimethylaminophenyl)methyl]-1-(5-indol-1-ylthiophene-2-carbonyl)piperidine-3-carboxamide CAS Name: N-[(4-dimethylaminophenyl)methyl]-1-[[5-(1-indolyl)-2-thiophenyl]-oxomethyl]-3-piperidinecarboxamide IUPAC Name: N-[(4-dimethylaminophenyl)methyl]-1-(5-indol-1-ylthiophene-2-carbonyl)piperidine-3-carboxamide Traditional Name: N-[4-(dimethylamino)benzyl]-1-(5-indol-1-ylthiophene-2-carbonyl)nipecotamide Formula: C28H30N4O2S MolecularWeight: 486.6284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CNC(=O)C2CCCN(C2)C(=O)C3=CC=C(S3)N4C=CC5=CC=CC=C54

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNC(=O)C2CCCN(C2)C(=O)C3=CC=C(S3)N4C=CC5=CC=CC=C54

InChI

InChI=1S/C28H30N4O2S/c1-30(2)23-11-9-20(10-12-23)18-29-27(33)22-7-5-16-31(19-22)28(34)25-13-14-26(35-25)32-17-15-21-6-3-4-8-24(21)32/h3-4,6,8-15,17,22H,5,7,16,18-19H2,1-2H3,(H,29,33)