1-(3-chlorophenyl)-4-[[3-[(4-isocyano-3-methoxy-phenyl)methyl]imidazol-4-yl]methyl]piperazin-2-one

Systemtic Name: 1-(3-chlorophenyl)-4-[[3-[(4-isocyano-3-methoxy-phenyl)methyl]imidazol-4-yl]methyl]piperazin-2-one Openeye Name: 1-(3-chlorophenyl)-4-[[3-[(4-isocyano-3-methoxy-phenyl)methyl]imidazol-4-yl]methyl]piperazin-2-one CAS Name: 1-(3-chlorophenyl)-4-[[3-[(4-isocyano-3-methoxyphenyl)methyl]-4-imidazolyl]methyl]-2-piperazinone IUPAC Name: 1-(3-chlorophenyl)-4-[[3-[(4-isocyano-3-methoxyphenyl)methyl]imidazol-4-yl]methyl]piperazin-2-one Traditional Name: 1-(3-chlorophenyl)-4-[[3-(4-isocyano-3-methoxy-benzyl)imidazol-4-yl]methyl]piperazin-2-one Formula: C23H22ClN5O2 MolecularWeight: 435.90608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN2C=NC=C2CN3CCN(C(=O)C3)C4=CC(=CC=C4)Cl)[N+]#[C-]

Isomeric SMILES

COC1=C(C=CC(=C1)CN2C=NC=C2CN3CCN(C(=O)C3)C4=CC(=CC=C4)Cl)[N+]#[C-]

InChI

InChI=1S/C23H22ClN5O2/c1-25-21-7-6-17(10-22(21)31-2)13-28-16-26-12-20(28)14-27-8-9-29(23(30)15-27)19-5-3-4-18(24)11-19/h3-7,10-12,16H,8-9,13-15H2,2H3