2-[2-[4-(5-carbamimidoylpyridin-2-yl)phenyl]-2-methanoyl-1-(4-methoxyphenyl)sulfonyl-pyrrolidin-3-yl]ethanoic acid

Systemtic Name: 2-[2-[4-(5-carbamimidoylpyridin-2-yl)phenyl]-2-methanoyl-1-(4-methoxyphenyl)sulfonyl-pyrrolidin-3-yl]ethanoic acid Openeye Name: 2-[2-[4-(5-carbamimidoyl-2-pyridyl)phenyl]-2-formyl-1-(4-methoxyphenyl)sulfonyl-pyrrolidin-3-yl]acetic acid CAS Name: 2-[2-[4-(5-carbamimidoyl-2-pyridinyl)phenyl]-2-formyl-1-(4-methoxyphenyl)sulfonyl-3-pyrrolidinyl]acetic acid IUPAC Name: 2-[2-[4-(5-carbamimidoylpyridin-2-yl)phenyl]-2-formyl-1-(4-methoxyphenyl)sulfonylpyrrolidin-3-yl]acetic acid Traditional Name: 2-[2-[4-(5-amidino-2-pyridyl)phenyl]-2-formyl-1-(4-methoxyphenyl)sulfonyl-pyrrolidin-3-yl]acetic acid Formula: C26H26N4O6S MolecularWeight: 522.57284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(C2(C=O)C3=CC=C(C=C3)C4=NC=C(C=C4)C(=N)N)CC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(C2(C=O)C3=CC=C(C=C3)C4=NC=C(C=C4)C(=N)N)CC(=O)O

InChI

InChI=1S/C26H26N4O6S/c1-36-21-7-9-22(10-8-21)37(34,35)30-13-12-20(14-24(32)33)26(30,16-31)19-5-2-17(3-6-19)23-11-4-18(15-29-23)25(27)28/h2-11,15-16,20H,12-14H2,1H3,(H3,27,28)(H,32,33)