1-[(3-carbamimidoylphenyl)methyl]-4-[(4-carbamimidoylphenyl)methyl]-N-methyl-pyrrole-3-carboxamide

Systemtic Name: 1-[(3-carbamimidoylphenyl)methyl]-4-[(4-carbamimidoylphenyl)methyl]-N-methyl-pyrrole-3-carboxamide Openeye Name: 1-[(3-carbamimidoylphenyl)methyl]-4-[(4-carbamimidoylphenyl)methyl]-N-methyl-pyrrole-3-carboxamide CAS Name: 1-[(3-carbamimidoylphenyl)methyl]-4-[(4-carbamimidoylphenyl)methyl]-N-methyl-3-pyrrolecarboxamide IUPAC Name: 1-[(3-carbamimidoylphenyl)methyl]-4-[(4-carbamimidoylphenyl)methyl]-N-methylpyrrole-3-carboxamide Traditional Name: 1-(3-amidinobenzyl)-4-(4-amidinobenzyl)-N-methyl-pyrrole-3-carboxamide Formula: C22H24N6O MolecularWeight: 388.46556

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CN(C=C1CC2=CC=C(C=C2)C(=N)N)CC3=CC=CC(=C3)C(=N)N

Isomeric SMILES

CNC(=O)C1=CN(C=C1CC2=CC=C(C=C2)C(=N)N)CC3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C22H24N6O/c1-27-22(29)19-13-28(11-15-3-2-4-17(10-15)21(25)26)12-18(19)9-14-5-7-16(8-6-14)20(23)24/h2-8,10,12-13H,9,11H2,1H3,(H3,23,24)(H3,25,26)(H,27,29)