1-[4-[3-(2-methoxyphenyl)-1-phenyl-pyrazol-4-yl]carbonylpiperazin-1-yl]-3-methyl-butan-1-one

Systemtic Name: 1-[4-[3-(2-methoxyphenyl)-1-phenyl-pyrazol-4-yl]carbonylpiperazin-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[4-[3-(2-methoxyphenyl)-1-phenyl-pyrazole-4-carbonyl]piperazin-1-yl]-3-methyl-butan-1-one CAS Name: 1-[4-[[3-(2-methoxyphenyl)-1-phenyl-4-pyrazolyl]-oxomethyl]-1-piperazinyl]-3-methyl-1-butanone IUPAC Name: 1-[4-[3-(2-methoxyphenyl)-1-phenylpyrazole-4-carbonyl]piperazin-1-yl]-3-methylbutan-1-one Traditional Name: 1-[4-[3-(2-methoxyphenyl)-1-phenyl-pyrazole-4-carbonyl]piperazino]-3-methyl-butan-1-one Formula: C26H30N4O3 MolecularWeight: 446.5414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCN(CC1)C(=O)C2=CN(N=C2C3=CC=CC=C3OC)C4=CC=CC=C4

Isomeric SMILES

CC(C)CC(=O)N1CCN(CC1)C(=O)C2=CN(N=C2C3=CC=CC=C3OC)C4=CC=CC=C4

InChI

InChI=1S/C26H30N4O3/c1-19(2)17-24(31)28-13-15-29(16-14-28)26(32)22-18-30(20-9-5-4-6-10-20)27-25(22)21-11-7-8-12-23(21)33-3/h4-12,18-19H,13-17H2,1-3H3