N-[2-[(4-methylpiperazin-1-yl)methyl]-1-propan-2-yl-benzimidazol-5-yl]-3-nitro-benzamide

Systemtic Name: N-[2-[(4-methylpiperazin-1-yl)methyl]-1-propan-2-yl-benzimidazol-5-yl]-3-nitro-benzamide Openeye Name: N-[1-isopropyl-2-[(4-methylpiperazin-1-yl)methyl]benzimidazol-5-yl]-3-nitro-benzamide CAS Name: N-[2-[(4-methyl-1-piperazinyl)methyl]-1-propan-2-yl-5-benzimidazolyl]-3-nitrobenzamide IUPAC Name: N-[2-[(4-methylpiperazin-1-yl)methyl]-1-propan-2-ylbenzimidazol-5-yl]-3-nitrobenzamide Traditional Name: N-[1-isopropyl-2-[(4-methylpiperazino)methyl]benzimidazol-5-yl]-3-nitro-benzamide Formula: C23H28N6O3 MolecularWeight: 436.50682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])N=C1CN4CCN(CC4)C

Isomeric SMILES

CC(C)N1C2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])N=C1CN4CCN(CC4)C

InChI

InChI=1S/C23H28N6O3/c1-16(2)28-21-8-7-18(24-23(30)17-5-4-6-19(13-17)29(31)32)14-20(21)25-22(28)15-27-11-9-26(3)10-12-27/h4-8,13-14,16H,9-12,15H2,1-3H3,(H,24,30)