3-[[7-bromanyl-3-[(3-carbamimidoylphenyl)methyl]-4-oxidanylidene-2-propan-2-yl-imidazo[4,5-c]pyridin-5-yl]methyl]benzenecarboximidamide

Systemtic Name: 3-[[7-bromanyl-3-[(3-carbamimidoylphenyl)methyl]-4-oxidanylidene-2-propan-2-yl-imidazo[4,5-c]pyridin-5-yl]methyl]benzenecarboximidamide Openeye Name: 3-[[7-bromo-3-[(3-carbamimidoylphenyl)methyl]-2-isopropyl-4-oxo-imidazo[4,5-c]pyridin-5-yl]methyl]benzamidine CAS Name: 3-[[7-bromo-3-[(3-carbamimidoylphenyl)methyl]-4-oxo-2-propan-2-yl-5-imidazo[4,5-c]pyridinyl]methyl]benzenecarboximidamide IUPAC Name: 3-[[7-bromo-3-[(3-carbamimidoylphenyl)methyl]-4-oxo-2-propan-2-ylimidazo[4,5-c]pyridin-5-yl]methyl]benzenecarboximidamide Traditional Name: 3-[[3-(3-amidinobenzyl)-7-bromo-2-isopropyl-4-keto-imidazo[4,5-c]pyridin-5-yl]methyl]benzamidine Formula: C25H26BrN7O MolecularWeight: 520.42424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(N1CC3=CC=CC(=C3)C(=N)N)C(=O)N(C=C2Br)CC4=CC=CC(=C4)C(=N)N

Isomeric SMILES

CC(C)C1=NC2=C(N1CC3=CC=CC(=C3)C(=N)N)C(=O)N(C=C2Br)CC4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C25H26BrN7O/c1-14(2)24-31-20-19(26)13-32(11-15-5-3-7-17(9-15)22(27)28)25(34)21(20)33(24)12-16-6-4-8-18(10-16)23(29)30/h3-10,13-14H,11-12H2,1-2H3,(H3,27,28)(H3,29,30)