4-[4-[[(1S)-cyclohex-3-en-1-yl]methyl]piperazin-1-yl]-2-(2-pyrazol-1-ylethyl)isoindole-1,3-dione

Systemtic Name: 4-[4-[[(1S)-cyclohex-3-en-1-yl]methyl]piperazin-1-yl]-2-(2-pyrazol-1-ylethyl)isoindole-1,3-dione Openeye Name: 4-[4-[[(1S)-cyclohex-3-en-1-yl]methyl]piperazin-1-yl]-2-(2-pyrazol-1-ylethyl)isoindoline-1,3-dione CAS Name: 4-[4-[[(1S)-1-cyclohex-3-enyl]methyl]-1-piperazinyl]-2-[2-(1-pyrazolyl)ethyl]isoindole-1,3-dione IUPAC Name: 4-[4-[[(1S)-cyclohex-3-en-1-yl]methyl]piperazin-1-yl]-2-(2-pyrazol-1-ylethyl)isoindole-1,3-dione Traditional Name: 4-[4-[[(1S)-cyclohex-3-en-1-yl]methyl]piperazino]-2-(2-pyrazol-1-ylethyl)isoindoline-1,3-quinone Formula: C24H29N5O2 MolecularWeight: 419.51936

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)CN2CCN(CC2)C3=CC=CC4=C3C(=O)N(C4=O)CCN5C=CC=N5

Isomeric SMILES

C1C[C@@H](CC=C1)CN2CCN(CC2)C3=CC=CC4=C3C(=O)N(C4=O)CCN5C=CC=N5

InChI

InChI=1S/C24H29N5O2/c30-23-20-8-4-9-21(22(20)24(31)29(23)17-16-28-11-5-10-25-28)27-14-12-26(13-15-27)18-19-6-2-1-3-7-19/h1-2,4-5,8-11,19H,3,6-7,12-18H2/t19-/m1/s1