N-(3-bromanyl-4-pyrrolidin-1-ylcarbonyl-phenyl)-2-(3-carbamimidoylphenyl)-3-phenyl-propanamide

Systemtic Name: N-(3-bromanyl-4-pyrrolidin-1-ylcarbonyl-phenyl)-2-(3-carbamimidoylphenyl)-3-phenyl-propanamide Openeye Name: N-[3-bromo-4-(pyrrolidine-1-carbonyl)phenyl]-2-(3-carbamimidoylphenyl)-3-phenyl-propanamide CAS Name: N-[3-bromo-4-[oxo(1-pyrrolidinyl)methyl]phenyl]-2-(3-carbamimidoylphenyl)-3-phenylpropanamide IUPAC Name: N-[3-bromo-4-(pyrrolidine-1-carbonyl)phenyl]-2-(3-carbamimidoylphenyl)-3-phenylpropanamide Traditional Name: 2-(3-amidinophenyl)-N-[3-bromo-4-(pyrrolidine-1-carbonyl)phenyl]-3-phenyl-propionamide Formula: C27H27BrN4O2 MolecularWeight: 519.43288

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=C(C=C(C=C2)NC(=O)C(CC3=CC=CC=C3)C4=CC=CC(=C4)C(=N)N)Br

Isomeric SMILES

C1CCN(C1)C(=O)C2=C(C=C(C=C2)NC(=O)C(CC3=CC=CC=C3)C4=CC=CC(=C4)C(=N)N)Br

InChI

InChI=1S/C27H27BrN4O2/c28-24-17-21(11-12-22(24)27(34)32-13-4-5-14-32)31-26(33)23(15-18-7-2-1-3-8-18)19-9-6-10-20(16-19)25(29)30/h1-3,6-12,16-17,23H,4-5,13-15H2,(H3,29,30)(H,31,33)