2-methyl-1-[4-[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]carbonylpiperazin-1-yl]propan-1-one

Systemtic Name: 2-methyl-1-[4-[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]carbonylpiperazin-1-yl]propan-1-one Openeye Name: 1-[4-(1-benzyl-3-phenyl-pyrazole-4-carbonyl)piperazin-1-yl]-2-methyl-propan-1-one CAS Name: 2-methyl-1-[4-[oxo-[3-phenyl-1-(phenylmethyl)-4-pyrazolyl]methyl]-1-piperazinyl]-1-propanone IUPAC Name: 1-[4-(1-benzyl-3-phenylpyrazole-4-carbonyl)piperazin-1-yl]-2-methylpropan-1-one Traditional Name: 1-[4-(1-benzyl-3-phenyl-pyrazole-4-carbonyl)piperazino]-2-methyl-propan-1-one Formula: C25H28N4O2 MolecularWeight: 416.51542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C(=O)C2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C(=O)C2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C25H28N4O2/c1-19(2)24(30)27-13-15-28(16-14-27)25(31)22-18-29(17-20-9-5-3-6-10-20)26-23(22)21-11-7-4-8-12-21/h3-12,18-19H,13-17H2,1-2H3