N-(4-cyclopentylsulfanylphenyl)-1-pyrazin-2-yl-piperidine-3-carboxamide

Systemtic Name: N-(4-cyclopentylsulfanylphenyl)-1-pyrazin-2-yl-piperidine-3-carboxamide Openeye Name: N-(4-cyclopentylsulfanylphenyl)-1-pyrazin-2-yl-piperidine-3-carboxamide CAS Name: N-[4-(cyclopentylthio)phenyl]-1-(2-pyrazinyl)-3-piperidinecarboxamide IUPAC Name: N-(4-cyclopentylsulfanylphenyl)-1-pyrazin-2-ylpiperidine-3-carboxamide Traditional Name: N-[4-(cyclopentylthio)phenyl]-1-pyrazin-2-yl-nipecotamide Formula: C21H26N4OS MolecularWeight: 382.52234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SC2=CC=C(C=C2)NC(=O)C3CCCN(C3)C4=NC=CN=C4

Isomeric SMILES

C1CCC(C1)SC2=CC=C(C=C2)NC(=O)C3CCCN(C3)C4=NC=CN=C4

InChI

InChI=1S/C21H26N4OS/c26-21(16-4-3-13-25(15-16)20-14-22-11-12-23-20)24-17-7-9-19(10-8-17)27-18-5-1-2-6-18/h7-12,14,16,18H,1-6,13,15H2,(H,24,26)