(2R)-N-(2-azanylethyl)-4-[(4-cyanophenyl)methyl-phenethyl-amino]-1-thiophen-2-ylcarbonyl-piperidine-2-carboxamide

Systemtic Name: (2R)-N-(2-azanylethyl)-4-[(4-cyanophenyl)methyl-phenethyl-amino]-1-thiophen-2-ylcarbonyl-piperidine-2-carboxamide Openeye Name: (2R)-N-(2-aminoethyl)-4-[(4-cyanophenyl)methyl-phenethyl-amino]-1-(thiophene-2-carbonyl)piperidine-2-carboxamide CAS Name: (2R)-N-(2-aminoethyl)-4-[(4-cyanophenyl)methyl-phenethylamino]-1-[oxo(thiophen-2-yl)methyl]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(2-aminoethyl)-4-[(4-cyanophenyl)methyl-phenethylamino]-1-(thiophene-2-carbonyl)piperidine-2-carboxamide Traditional Name: (2R)-N-(2-aminoethyl)-4-[(4-cyanobenzyl)-phenethyl-amino]-1-(2-thenoyl)pipecolinamide Formula: C29H33N5O2S MolecularWeight: 515.66962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CC1N(CCC2=CC=CC=C2)CC3=CC=C(C=C3)C#N)C(=O)NCCN)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN([C@H](CC1N(CCC2=CC=CC=C2)CC3=CC=C(C=C3)C#N)C(=O)NCCN)C(=O)C4=CC=CS4

InChI

InChI=1S/C29H33N5O2S/c30-14-15-32-28(35)26-19-25(13-17-34(26)29(36)27-7-4-18-37-27)33(16-12-22-5-2-1-3-6-22)21-24-10-8-23(20-31)9-11-24/h1-11,18,25-26H,12-17,19,21,30H2,(H,32,35)/t25?,26-/m1/s1