N-[[4-(aminomethyl)phenyl]methyl]-3-azanyl-4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]benzamide

Systemtic Name: N-[[4-(aminomethyl)phenyl]methyl]-3-azanyl-4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]benzamide Openeye Name: 3-amino-N-[[4-(aminomethyl)phenyl]methyl]-4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]benzamide CAS Name: 3-amino-N-[[4-(aminomethyl)phenyl]methyl]-4-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]benzamide IUPAC Name: 3-amino-N-[[4-(aminomethyl)phenyl]methyl]-4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]benzamide Traditional Name: 3-amino-N-[4-(aminomethyl)benzyl]-4-[[4-(2-pyrimidyl)piperazino]methyl]benzamide Formula: C24H29N7O MolecularWeight: 431.53336

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=C(C=C2)C(=O)NCC3=CC=C(C=C3)CN)N)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCN1CC2=C(C=C(C=C2)C(=O)NCC3=CC=C(C=C3)CN)N)C4=NC=CC=N4

InChI

InChI=1S/C24H29N7O/c25-15-18-2-4-19(5-3-18)16-29-23(32)20-6-7-21(22(26)14-20)17-30-10-12-31(13-11-30)24-27-8-1-9-28-24/h1-9,14H,10-13,15-17,25-26H2,(H,29,32)