N'-[1-[3-bromanyl-4-(2-dimethylaminoethyloxy)phenyl]ethyl]-N-(4-carbamimidoylphenyl)propanediamide

Systemtic Name: N'-[1-[3-bromanyl-4-(2-dimethylaminoethyloxy)phenyl]ethyl]-N-(4-carbamimidoylphenyl)propanediamide Openeye Name: N'-[1-[3-bromo-4-(2-dimethylaminoethyloxy)phenyl]ethyl]-N-(4-carbamimidoylphenyl)propanediamide CAS Name: N'-[1-[3-bromo-4-(2-dimethylaminoethyloxy)phenyl]ethyl]-N-(4-carbamimidoylphenyl)propanediamide IUPAC Name: N'-[1-[3-bromo-4-(2-dimethylaminoethyloxy)phenyl]ethyl]-N-(4-carbamimidoylphenyl)propanediamide Traditional Name: N-(4-amidinophenyl)-N'-[1-[3-bromo-4-(2-dimethylaminoethyloxy)phenyl]ethyl]malonamide Formula: C22H28BrN5O3 MolecularWeight: 490.39342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OCCN(C)C)Br)NC(=O)CC(=O)NC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CC(C1=CC(=C(C=C1)OCCN(C)C)Br)NC(=O)CC(=O)NC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C22H28BrN5O3/c1-14(16-6-9-19(18(23)12-16)31-11-10-28(2)3)26-20(29)13-21(30)27-17-7-4-15(5-8-17)22(24)25/h4-9,12,14H,10-11,13H2,1-3H3,(H3,24,25)(H,26,29)(H,27,30)