3-azanyl-N-(2-azanylethyl)-4-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]benzamide

Systemtic Name: 3-azanyl-N-(2-azanylethyl)-4-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]benzamide Openeye Name: 3-amino-N-(2-aminoethyl)-4-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]benzamide CAS Name: 3-amino-N-(2-aminoethyl)-4-[[4-(4-fluorophenyl)-1-piperazinyl]methyl]benzamide IUPAC Name: 3-amino-N-(2-aminoethyl)-4-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]benzamide Traditional Name: 3-amino-N-(2-aminoethyl)-4-[[4-(4-fluorophenyl)piperazino]methyl]benzamide Formula: C20H26FN5O MolecularWeight: 371.451743

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=C(C=C2)C(=O)NCCN)N)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN1CC2=C(C=C(C=C2)C(=O)NCCN)N)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H26FN5O/c21-17-3-5-18(6-4-17)26-11-9-25(10-12-26)14-16-2-1-15(13-19(16)23)20(27)24-8-7-22/h1-6,13H,7-12,14,22-23H2,(H,24,27)