1-(3-carbamimidoylphenyl)-N-(4-imidazol-1-ylphenyl)-4-methyl-pyrrole-2-carboxamide

Systemtic Name: 1-(3-carbamimidoylphenyl)-N-(4-imidazol-1-ylphenyl)-4-methyl-pyrrole-2-carboxamide Openeye Name: 1-(3-carbamimidoylphenyl)-N-(4-imidazol-1-ylphenyl)-4-methyl-pyrrole-2-carboxamide CAS Name: 1-(3-carbamimidoylphenyl)-N-[4-(1-imidazolyl)phenyl]-4-methyl-2-pyrrolecarboxamide IUPAC Name: 1-(3-carbamimidoylphenyl)-N-(4-imidazol-1-ylphenyl)-4-methylpyrrole-2-carboxamide Traditional Name: 1-(3-amidinophenyl)-N-(4-imidazol-1-ylphenyl)-4-methyl-pyrrole-2-carboxamide Formula: C22H20N6O MolecularWeight: 384.4338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=C1)C(=O)NC2=CC=C(C=C2)N3C=CN=C3)C4=CC=CC(=C4)C(=N)N

Isomeric SMILES

CC1=CN(C(=C1)C(=O)NC2=CC=C(C=C2)N3C=CN=C3)C4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C22H20N6O/c1-15-11-20(28(13-15)19-4-2-3-16(12-19)21(23)24)22(29)26-17-5-7-18(8-6-17)27-10-9-25-14-27/h2-14H,1H3,(H3,23,24)(H,26,29)