3-[[(2-azanyl-2-oxidanylidene-ethyl)-(piperidin-4-ylmethyl)amino]methyl]-5-(3-carbamimidoylphenyl)benzamide

Systemtic Name: 3-[[(2-azanyl-2-oxidanylidene-ethyl)-(piperidin-4-ylmethyl)amino]methyl]-5-(3-carbamimidoylphenyl)benzamide Openeye Name: 3-[[(2-amino-2-oxo-ethyl)-(4-piperidylmethyl)amino]methyl]-5-(3-carbamimidoylphenyl)benzamide CAS Name: 3-[[(2-amino-2-oxoethyl)-(4-piperidinylmethyl)amino]methyl]-5-(3-carbamimidoylphenyl)benzamide IUPAC Name: 3-[[(2-amino-2-oxoethyl)-(piperidin-4-ylmethyl)amino]methyl]-5-(3-carbamimidoylphenyl)benzamide Traditional Name: 3-(3-amidinophenyl)-5-[[(2-amino-2-keto-ethyl)-(4-piperidylmethyl)amino]methyl]benzamide Formula: C23H30N6O2 MolecularWeight: 422.5233

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CN(CC2=CC(=CC(=C2)C(=O)N)C3=CC(=CC=C3)C(=N)N)CC(=O)N

Isomeric SMILES

C1CNCCC1CN(CC2=CC(=CC(=C2)C(=O)N)C3=CC(=CC=C3)C(=N)N)CC(=O)N

InChI

InChI=1S/C23H30N6O2/c24-21(30)14-29(12-15-4-6-28-7-5-15)13-16-8-19(11-20(9-16)23(27)31)17-2-1-3-18(10-17)22(25)26/h1-3,8-11,15,28H,4-7,12-14H2,(H2,24,30)(H3,25,26)(H2,27,31)