4-[2-[[(5-carbamimidoylpyridin-2-yl)amino]methyl]-4-ethenyl-5-methoxy-phenyl]-N-(2-methylpropyl)benzamide

Systemtic Name: 4-[2-[[(5-carbamimidoylpyridin-2-yl)amino]methyl]-4-ethenyl-5-methoxy-phenyl]-N-(2-methylpropyl)benzamide Openeye Name: 4-[2-[[(5-carbamimidoyl-2-pyridyl)amino]methyl]-5-methoxy-4-vinyl-phenyl]-N-isobutyl-benzamide CAS Name: 4-[2-[[(5-carbamimidoyl-2-pyridinyl)amino]methyl]-4-ethenyl-5-methoxyphenyl]-N-(2-methylpropyl)benzamide IUPAC Name: 4-[2-[[(5-carbamimidoylpyridin-2-yl)amino]methyl]-4-ethenyl-5-methoxyphenyl]-N-(2-methylpropyl)benzamide Traditional Name: 4-[2-[[(5-amidino-2-pyridyl)amino]methyl]-5-methoxy-4-vinyl-phenyl]-N-isobutyl-benzamide Formula: C27H31N5O2 MolecularWeight: 457.56734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2CNC3=NC=C(C=C3)C(=N)N)C=C)OC

Isomeric SMILES

CC(C)CNC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2CNC3=NC=C(C=C3)C(=N)N)C=C)OC

InChI

InChI=1S/C27H31N5O2/c1-5-18-12-22(16-31-25-11-10-21(15-30-25)26(28)29)23(13-24(18)34-4)19-6-8-20(9-7-19)27(33)32-14-17(2)3/h5-13,15,17H,1,14,16H2,2-4H3,(H3,28,29)(H,30,31)(H,32,33)