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

Systemtic Name: N'-[1-[3-bromanyl-4-(2-morpholin-4-ylethoxy)phenyl]ethyl]-N-(4-carbamimidoylphenyl)propanediamide Openeye Name: N'-[1-[3-bromo-4-(2-morpholinoethoxy)phenyl]ethyl]-N-(4-carbamimidoylphenyl)propanediamide CAS Name: N'-[1-[3-bromo-4-[2-(4-morpholinyl)ethoxy]phenyl]ethyl]-N-(4-carbamimidoylphenyl)propanediamide IUPAC Name: N'-[1-[3-bromo-4-(2-morpholin-4-ylethoxy)phenyl]ethyl]-N-(4-carbamimidoylphenyl)propanediamide Traditional Name: N-(4-amidinophenyl)-N'-[1-[3-bromo-4-(2-morpholinoethoxy)phenyl]ethyl]malonamide Formula: C24H30BrN5O4 MolecularWeight: 532.4301

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OCCN2CCOCC2)Br)NC(=O)CC(=O)NC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC(C1=CC(=C(C=C1)OCCN2CCOCC2)Br)NC(=O)CC(=O)NC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C24H30BrN5O4/c1-16(28-22(31)15-23(32)29-19-5-2-17(3-6-19)24(26)27)18-4-7-21(20(25)14-18)34-13-10-30-8-11-33-12-9-30/h2-7,14,16H,8-13,15H2,1H3,(H3,26,27)(H,28,31)(H,29,32)