N-[2-[(4-ethylpiperazin-1-yl)methyl]-1-propyl-benzimidazol-5-yl]-4-nitro-benzamide

Systemtic Name: N-[2-[(4-ethylpiperazin-1-yl)methyl]-1-propyl-benzimidazol-5-yl]-4-nitro-benzamide Openeye Name: N-[2-[(4-ethylpiperazin-1-yl)methyl]-1-propyl-benzimidazol-5-yl]-4-nitro-benzamide CAS Name: N-[2-[(4-ethyl-1-piperazinyl)methyl]-1-propyl-5-benzimidazolyl]-4-nitrobenzamide IUPAC Name: N-[2-[(4-ethylpiperazin-1-yl)methyl]-1-propylbenzimidazol-5-yl]-4-nitrobenzamide Traditional Name: N-[2-[(4-ethylpiperazino)methyl]-1-propyl-benzimidazol-5-yl]-4-nitro-benzamide Formula: C24H30N6O3 MolecularWeight: 450.5334

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])N=C1CN4CCN(CC4)CC

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])N=C1CN4CCN(CC4)CC

InChI

InChI=1S/C24H30N6O3/c1-3-11-29-22-10-7-19(25-24(31)18-5-8-20(9-6-18)30(32)33)16-21(22)26-23(29)17-28-14-12-27(4-2)13-15-28/h5-10,16H,3-4,11-15,17H2,1-2H3,(H,25,31)