3-(3,5-dimethylpyrazol-1-yl)-1-[4-[(3-methylphenyl)methyl]piperazin-1-yl]propan-1-one

Systemtic Name: 3-(3,5-dimethylpyrazol-1-yl)-1-[4-[(3-methylphenyl)methyl]piperazin-1-yl]propan-1-one Openeye Name: 3-(3,5-dimethylpyrazol-1-yl)-1-[4-(m-tolylmethyl)piperazin-1-yl]propan-1-one CAS Name: 3-(3,5-dimethyl-1-pyrazolyl)-1-[4-[(3-methylphenyl)methyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-(3,5-dimethylpyrazol-1-yl)-1-[4-[(3-methylphenyl)methyl]piperazin-1-yl]propan-1-one Traditional Name: 3-(3,5-dimethylpyrazol-1-yl)-1-[4-(3-methylbenzyl)piperazino]propan-1-one Formula: C20H28N4O MolecularWeight: 340.46252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)CCN3C(=CC(=N3)C)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)CCN3C(=CC(=N3)C)C

InChI

InChI=1S/C20H28N4O/c1-16-5-4-6-19(13-16)15-22-9-11-23(12-10-22)20(25)7-8-24-18(3)14-17(2)21-24/h4-6,13-14H,7-12,15H2,1-3H3