6-[[4-[2-(4-tert-butylphenyl)-1H-benzimidazol-4-yl]piperazin-1-yl]methyl]-4-methyl-1H-quinoxaline-2,3-dione

Systemtic Name: 6-[[4-[2-(4-tert-butylphenyl)-1H-benzimidazol-4-yl]piperazin-1-yl]methyl]-4-methyl-1H-quinoxaline-2,3-dione Openeye Name: 6-[[4-[2-(4-tert-butylphenyl)-1H-benzimidazol-4-yl]piperazin-1-yl]methyl]-4-methyl-1H-quinoxaline-2,3-dione CAS Name: 6-[[4-[2-(4-tert-butylphenyl)-1H-benzimidazol-4-yl]-1-piperazinyl]methyl]-4-methyl-1H-quinoxaline-2,3-dione IUPAC Name: 6-[[4-[2-(4-tert-butylphenyl)-1H-benzimidazol-4-yl]piperazin-1-yl]methyl]-4-methyl-1H-quinoxaline-2,3-dione Traditional Name: 6-[[4-[2-(4-tert-butylphenyl)-1H-benzimidazol-4-yl]piperazino]methyl]-4-methyl-1H-quinoxaline-2,3-quinone Formula: C31H34N6O2 MolecularWeight: 522.64066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(N2)C=CC=C3N4CCN(CC4)CC5=CC6=C(C=C5)NC(=O)C(=O)N6C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(N2)C=CC=C3N4CCN(CC4)CC5=CC6=C(C=C5)NC(=O)C(=O)N6C

InChI

InChI=1S/C31H34N6O2/c1-31(2,3)22-11-9-21(10-12-22)28-32-24-6-5-7-25(27(24)34-28)37-16-14-36(15-17-37)19-20-8-13-23-26(18-20)35(4)30(39)29(38)33-23/h5-13,18H,14-17,19H2,1-4H3,(H,32,34)(H,33,38)