5-[(3S)-4-[1-(4-chlorophenyl)carbonylpiperidin-4-yl]-3-ethyl-piperazin-1-yl]-4-methyl-pyridine-2-carboxamide

Systemtic Name: 5-[(3S)-4-[1-(4-chlorophenyl)carbonylpiperidin-4-yl]-3-ethyl-piperazin-1-yl]-4-methyl-pyridine-2-carboxamide Openeye Name: 5-[(3S)-4-[1-(4-chlorobenzoyl)-4-piperidyl]-3-ethyl-piperazin-1-yl]-4-methyl-pyridine-2-carboxamide CAS Name: 5-[(3S)-4-[1-[(4-chlorophenyl)-oxomethyl]-4-piperidinyl]-3-ethyl-1-piperazinyl]-4-methyl-2-pyridinecarboxamide IUPAC Name: 5-[(3S)-4-[1-(4-chlorobenzoyl)piperidin-4-yl]-3-ethylpiperazin-1-yl]-4-methylpyridine-2-carboxamide Traditional Name: 5-[(3S)-4-[1-(4-chlorobenzoyl)-4-piperidyl]-3-ethyl-piperazino]-4-methyl-picolinamide Formula: C25H32ClN5O2 MolecularWeight: 470.00688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CCN1C2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl)C4=CN=C(C=C4C)C(=O)N

Isomeric SMILES

CC[C@H]1CN(CCN1C2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl)C4=CN=C(C=C4C)C(=O)N

InChI

InChI=1S/C25H32ClN5O2/c1-3-20-16-30(23-15-28-22(24(27)32)14-17(23)2)12-13-31(20)21-8-10-29(11-9-21)25(33)18-4-6-19(26)7-5-18/h4-7,14-15,20-21H,3,8-13,16H2,1-2H3,(H2,27,32)/t20-/m0/s1