[4-[[bis(1H-imidazol-2-ylmethyl)amino]methyl]phenyl]-(4-propylpiperazin-1-yl)methanone

Systemtic Name: [4-[[bis(1H-imidazol-2-ylmethyl)amino]methyl]phenyl]-(4-propylpiperazin-1-yl)methanone Openeye Name: [4-[[bis(1H-imidazol-2-ylmethyl)amino]methyl]phenyl]-(4-propylpiperazin-1-yl)methanone CAS Name: [4-[[bis(1H-imidazol-2-ylmethyl)amino]methyl]phenyl]-(4-propyl-1-piperazinyl)methanone IUPAC Name: [4-[[bis(1H-imidazol-2-ylmethyl)amino]methyl]phenyl]-(4-propylpiperazin-1-yl)methanone Traditional Name: [4-[[bis(1H-imidazol-2-ylmethyl)amino]methyl]phenyl]-(4-propylpiperazino)methanone Formula: C23H31N7O MolecularWeight: 421.53854

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C(=O)C2=CC=C(C=C2)CN(CC3=NC=CN3)CC4=NC=CN4

Isomeric SMILES

CCCN1CCN(CC1)C(=O)C2=CC=C(C=C2)CN(CC3=NC=CN3)CC4=NC=CN4

InChI

InChI=1S/C23H31N7O/c1-2-11-28-12-14-30(15-13-28)23(31)20-5-3-19(4-6-20)16-29(17-21-24-7-8-25-21)18-22-26-9-10-27-22/h3-10H,2,11-18H2,1H3,(H,24,25)(H,26,27)