2-[2-(4-bromophenyl)-5-phenyl-pyrrol-1-yl]-N-[N'-(3-oxidanylpropyl)carbamimidoyl]ethanamide

Systemtic Name: 2-[2-(4-bromophenyl)-5-phenyl-pyrrol-1-yl]-N-[N'-(3-oxidanylpropyl)carbamimidoyl]ethanamide Openeye Name: 2-[2-(4-bromophenyl)-5-phenyl-pyrrol-1-yl]-N-[N'-(3-hydroxypropyl)carbamimidoyl]acetamide CAS Name: N-[amino(3-hydroxypropylimino)methyl]-2-[2-(4-bromophenyl)-5-phenyl-1-pyrrolyl]acetamide IUPAC Name: 2-[2-(4-bromophenyl)-5-phenylpyrrol-1-yl]-N-[N'-(3-hydroxypropyl)carbamimidoyl]acetamide Traditional Name: 2-[2-(4-bromophenyl)-5-phenyl-pyrrol-1-yl]-N-[N'-(3-hydroxypropyl)amidino]acetamide Formula: C22H23BrN4O2 MolecularWeight: 455.34762

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(N2CC(=O)NC(=NCCCO)N)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(N2CC(=O)NC(=NCCCO)N)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H23BrN4O2/c23-18-9-7-17(8-10-18)20-12-11-19(16-5-2-1-3-6-16)27(20)15-21(29)26-22(24)25-13-4-14-28/h1-3,5-12,28H,4,13-15H2,(H3,24,25,26,29)