1-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-3-(1-phenylpyrazol-4-yl)propan-1-one

Systemtic Name: 1-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-3-(1-phenylpyrazol-4-yl)propan-1-one Openeye Name: 1-[4-(o-tolylmethyl)piperazin-1-yl]-3-(1-phenylpyrazol-4-yl)propan-1-one CAS Name: 1-[4-[(2-methylphenyl)methyl]-1-piperazinyl]-3-(1-phenyl-4-pyrazolyl)-1-propanone IUPAC Name: 1-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-3-(1-phenylpyrazol-4-yl)propan-1-one Traditional Name: 1-[4-(2-methylbenzyl)piperazino]-3-(1-phenylpyrazol-4-yl)propan-1-one Formula: C24H28N4O MolecularWeight: 388.50532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)C(=O)CCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)C(=O)CCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H28N4O/c1-20-7-5-6-8-22(20)19-26-13-15-27(16-14-26)24(29)12-11-21-17-25-28(18-21)23-9-3-2-4-10-23/h2-10,17-18H,11-16,19H2,1H3