5-[4-[1-[(4-chlorophenyl)methyl]pyrrolidin-3-yl]piperidin-1-yl]carbonyl-1H-pyrazin-2-one

Systemtic Name: 5-[4-[1-[(4-chlorophenyl)methyl]pyrrolidin-3-yl]piperidin-1-yl]carbonyl-1H-pyrazin-2-one Openeye Name: 5-[4-[1-[(4-chlorophenyl)methyl]pyrrolidin-3-yl]piperidine-1-carbonyl]-1H-pyrazin-2-one CAS Name: 5-[[4-[1-[(4-chlorophenyl)methyl]-3-pyrrolidinyl]-1-piperidinyl]-oxomethyl]-1H-pyrazin-2-one IUPAC Name: 5-[4-[1-[(4-chlorophenyl)methyl]pyrrolidin-3-yl]piperidine-1-carbonyl]-1H-pyrazin-2-one Traditional Name: 5-[4-[1-(4-chlorobenzyl)pyrrolidin-3-yl]piperidine-1-carbonyl]-1H-pyrazin-2-one Formula: C21H25ClN4O2 MolecularWeight: 400.9018

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2CCN(C2)CC3=CC=C(C=C3)Cl)C(=O)C4=CNC(=O)C=N4

Isomeric SMILES

C1CN(CCC1C2CCN(C2)CC3=CC=C(C=C3)Cl)C(=O)C4=CNC(=O)C=N4

InChI

InChI=1S/C21H25ClN4O2/c22-18-3-1-15(2-4-18)13-25-8-5-17(14-25)16-6-9-26(10-7-16)21(28)19-11-24-20(27)12-23-19/h1-4,11-12,16-17H,5-10,13-14H2,(H,24,27)