5-(tert-butylcarbamoyl)-2-[2-[(4-carbamimidoylphenyl)carbamoyl]-6-methoxy-pyridin-3-yl]benzoic acid

Systemtic Name: 5-(tert-butylcarbamoyl)-2-[2-[(4-carbamimidoylphenyl)carbamoyl]-6-methoxy-pyridin-3-yl]benzoic acid Openeye Name: 5-(tert-butylcarbamoyl)-2-[2-[(4-carbamimidoylphenyl)carbamoyl]-6-methoxy-3-pyridyl]benzoic acid CAS Name: 5-[(tert-butylamino)-oxomethyl]-2-[2-[(4-carbamimidoylanilino)-oxomethyl]-6-methoxy-3-pyridinyl]benzoic acid IUPAC Name: 5-(tert-butylcarbamoyl)-2-[2-[(4-carbamimidoylphenyl)carbamoyl]-6-methoxypyridin-3-yl]benzoic acid Traditional Name: 2-[2-[(4-amidinophenyl)carbamoyl]-6-methoxy-3-pyridyl]-5-(tert-butylcarbamoyl)benzoic acid Formula: C26H27N5O5 MolecularWeight: 489.52308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC(=C(C=C1)C2=C(N=C(C=C2)OC)C(=O)NC3=CC=C(C=C3)C(=N)N)C(=O)O

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC(=C(C=C1)C2=C(N=C(C=C2)OC)C(=O)NC3=CC=C(C=C3)C(=N)N)C(=O)O

InChI

InChI=1S/C26H27N5O5/c1-26(2,3)31-23(32)15-7-10-17(19(13-15)25(34)35)18-11-12-20(36-4)30-21(18)24(33)29-16-8-5-14(6-9-16)22(27)28/h5-13H,1-4H3,(H3,27,28)(H,29,33)(H,31,32)(H,34,35)