(3R,4S)-N-(1-benzothiophen-3-ylmethyl)-N-cyclopropyl-4-(3-phenylphenyl)piperidine-3-carboxamide

Systemtic Name: (3R,4S)-N-(1-benzothiophen-3-ylmethyl)-N-cyclopropyl-4-(3-phenylphenyl)piperidine-3-carboxamide Openeye Name: (3R,4S)-N-(benzothiophen-3-ylmethyl)-N-cyclopropyl-4-(3-phenylphenyl)piperidine-3-carboxamide CAS Name: (3R,4S)-N-(1-benzothiophen-3-ylmethyl)-N-cyclopropyl-4-(3-phenylphenyl)-3-piperidinecarboxamide IUPAC Name: (3R,4S)-N-(1-benzothiophen-3-ylmethyl)-N-cyclopropyl-4-(3-phenylphenyl)piperidine-3-carboxamide Traditional Name: (3R,4S)-N-(benzothiophen-3-ylmethyl)-N-cyclopropyl-4-(3-phenylphenyl)nipecotamide Formula: C30H30N2OS MolecularWeight: 466.637

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CSC3=CC=CC=C32)C(=O)C4CNCCC4C5=CC=CC(=C5)C6=CC=CC=C6

Isomeric SMILES

C1CNC[C@@H]([C@H]1C2=CC=CC(=C2)C3=CC=CC=C3)C(=O)N(CC4=CSC5=CC=CC=C54)C6CC6

InChI

InChI=1S/C30H30N2OS/c33-30(32(25-13-14-25)19-24-20-34-29-12-5-4-11-27(24)29)28-18-31-16-15-26(28)23-10-6-9-22(17-23)21-7-2-1-3-8-21/h1-12,17,20,25-26,28,31H,13-16,18-19H2/t26-,28+/m1/s1