1-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]-2,3-dihydroindole

Systemtic Name: 1-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]-2,3-dihydroindole Openeye Name: 1-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]indoline CAS Name: 1-[5-nitro-6-(4-phenyl-1-piperazinyl)-4-pyrimidinyl]-2,3-dihydroindole IUPAC Name: 1-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]-2,3-dihydroindole Traditional Name: 1-[5-nitro-6-(4-phenylpiperazino)pyrimidin-4-yl]indoline Formula: C22H22N6O2 MolecularWeight: 402.44908

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)C3=C(C(=NC=N3)N4CCN(CC4)C5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(C2=CC=CC=C21)C3=C(C(=NC=N3)N4CCN(CC4)C5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H22N6O2/c29-28(30)20-21(26-14-12-25(13-15-26)18-7-2-1-3-8-18)23-16-24-22(20)27-11-10-17-6-4-5-9-19(17)27/h1-9,16H,10-15H2