1-[(4-carbamimidoylnaphthalen-1-yl)methyl]-6-(piperidin-4-ylamino)-2-propan-2-yl-benzimidazole-4-carboxamide

Systemtic Name: 1-[(4-carbamimidoylnaphthalen-1-yl)methyl]-6-(piperidin-4-ylamino)-2-propan-2-yl-benzimidazole-4-carboxamide Openeye Name: 1-[(4-carbamimidoyl-1-naphthyl)methyl]-2-isopropyl-6-(4-piperidylamino)benzimidazole-4-carboxamide CAS Name: 1-[(4-carbamimidoyl-1-naphthalenyl)methyl]-6-(4-piperidinylamino)-2-propan-2-yl-4-benzimidazolecarboxamide IUPAC Name: 1-[(4-carbamimidoylnaphthalen-1-yl)methyl]-6-(piperidin-4-ylamino)-2-propan-2-ylbenzimidazole-4-carboxamide Traditional Name: 1-[(4-amidino-1-naphthyl)methyl]-2-isopropyl-6-(4-piperidylamino)benzimidazole-4-carboxamide Formula: C28H33N7O MolecularWeight: 483.60792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(N1CC3=CC=C(C4=CC=CC=C34)C(=N)N)C=C(C=C2C(=O)N)NC5CCNCC5

Isomeric SMILES

CC(C)C1=NC2=C(N1CC3=CC=C(C4=CC=CC=C34)C(=N)N)C=C(C=C2C(=O)N)NC5CCNCC5

InChI

InChI=1S/C28H33N7O/c1-16(2)28-34-25-23(27(31)36)13-19(33-18-9-11-32-12-10-18)14-24(25)35(28)15-17-7-8-22(26(29)30)21-6-4-3-5-20(17)21/h3-8,13-14,16,18,32-33H,9-12,15H2,1-2H3,(H3,29,30)(H2,31,36)