5-butyl-1-(2,3-dimethylphenyl)-4-(1H-imidazol-5-ylmethyl)piperazin-2-one

Systemtic Name: 5-butyl-1-(2,3-dimethylphenyl)-4-(1H-imidazol-5-ylmethyl)piperazin-2-one Openeye Name: 5-butyl-1-(2,3-dimethylphenyl)-4-(1H-imidazol-5-ylmethyl)piperazin-2-one CAS Name: 5-butyl-1-(2,3-dimethylphenyl)-4-(1H-imidazol-5-ylmethyl)-2-piperazinone IUPAC Name: 5-butyl-1-(2,3-dimethylphenyl)-4-(1H-imidazol-5-ylmethyl)piperazin-2-one Traditional Name: 5-butyl-1-(2,3-dimethylphenyl)-4-(1H-imidazol-5-ylmethyl)piperazin-2-one Formula: C20H28N4O MolecularWeight: 340.46252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CN(C(=O)CN1CC2=CN=CN2)C3=CC=CC(=C3C)C

Isomeric SMILES

CCCCC1CN(C(=O)CN1CC2=CN=CN2)C3=CC=CC(=C3C)C

InChI

InChI=1S/C20H28N4O/c1-4-5-8-18-12-24(19-9-6-7-15(2)16(19)3)20(25)13-23(18)11-17-10-21-14-22-17/h6-7,9-10,14,18H,4-5,8,11-13H2,1-3H3,(H,21,22)