1-[3,5-bis(4-bromophenyl)-3,4-dihydropyrazol-2-yl]-3-(4-phenylpiperazin-1-yl)propan-1-one

Systemtic Name: 1-[3,5-bis(4-bromophenyl)-3,4-dihydropyrazol-2-yl]-3-(4-phenylpiperazin-1-yl)propan-1-one Openeye Name: 1-[3,5-bis(4-bromophenyl)-3,4-dihydropyrazol-2-yl]-3-(4-phenylpiperazin-1-yl)propan-1-one CAS Name: 1-[3,5-bis(4-bromophenyl)-3,4-dihydropyrazol-2-yl]-3-(4-phenyl-1-piperazinyl)-1-propanone IUPAC Name: 1-[3,5-bis(4-bromophenyl)-3,4-dihydropyrazol-2-yl]-3-(4-phenylpiperazin-1-yl)propan-1-one Traditional Name: 1-[3,5-bis(4-bromophenyl)-2-pyrazolin-1-yl]-3-(4-phenylpiperazino)propan-1-one Formula: C28H28Br2N4O MolecularWeight: 596.35612

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)N2C(CC(=N2)C3=CC=C(C=C3)Br)C4=CC=C(C=C4)Br)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCC(=O)N2C(CC(=N2)C3=CC=C(C=C3)Br)C4=CC=C(C=C4)Br)C5=CC=CC=C5

InChI

InChI=1S/C28H28Br2N4O/c29-23-10-6-21(7-11-23)26-20-27(22-8-12-24(30)13-9-22)34(31-26)28(35)14-15-32-16-18-33(19-17-32)25-4-2-1-3-5-25/h1-13,27H,14-20H2