N-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]-4-pentyl-N-[(4-thiomorpholin-4-ylphenyl)methyl]benzamide

Systemtic Name: N-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]-4-pentyl-N-[(4-thiomorpholin-4-ylphenyl)methyl]benzamide Openeye Name: N-[1-(1H-imidazol-2-ylmethyl)-4-piperidyl]-4-pentyl-N-[(4-thiomorpholinophenyl)methyl]benzamide CAS Name: N-[1-(1H-imidazol-2-ylmethyl)-4-piperidinyl]-4-pentyl-N-[(4-thiomorpholin-4-ylphenyl)methyl]benzamide IUPAC Name: N-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]-4-pentyl-N-[(4-thiomorpholin-4-ylphenyl)methyl]benzamide Traditional Name: 4-amyl-N-[1-(1H-imidazol-2-ylmethyl)-4-piperidyl]-N-(4-thiomorpholinobenzyl)benzamide Formula: C32H43N5OS MolecularWeight: 545.78172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N(CC2=CC=C(C=C2)N3CCSCC3)C4CCN(CC4)CC5=NC=CN5

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N(CC2=CC=C(C=C2)N3CCSCC3)C4CCN(CC4)CC5=NC=CN5

InChI

InChI=1S/C32H43N5OS/c1-2-3-4-5-26-6-10-28(11-7-26)32(38)37(30-14-18-35(19-15-30)25-31-33-16-17-34-31)24-27-8-12-29(13-9-27)36-20-22-39-23-21-36/h6-13,16-17,30H,2-5,14-15,18-25H2,1H3,(H,33,34)