1-[4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]piperazin-1-yl]-4-(1H-indol-3-yl)butan-1-one

Systemtic Name: 1-[4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]piperazin-1-yl]-4-(1H-indol-3-yl)butan-1-one Openeye Name: 1-[4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]piperazin-1-yl]-4-(1H-indol-3-yl)butan-1-one CAS Name: 1-[4-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-1-piperazinyl]-4-(1H-indol-3-yl)-1-butanone IUPAC Name: 1-[4-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]piperazin-1-yl]-4-(1H-indol-3-yl)butan-1-one Traditional Name: 1-[4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]piperazino]-4-(1H-indol-3-yl)butan-1-one Formula: C28H33N5O MolecularWeight: 455.59452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CN3CCN(CC3)C(=O)CCCC4=CNC5=CC=CC=C54

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CN3CCN(CC3)C(=O)CCCC4=CNC5=CC=CC=C54

InChI

InChI=1S/C28H33N5O/c1-21-26(22(2)33(30-21)24-10-4-3-5-11-24)20-31-15-17-32(18-16-31)28(34)14-8-9-23-19-29-27-13-7-6-12-25(23)27/h3-7,10-13,19,29H,8-9,14-18,20H2,1-2H3