pyridin-3-yl 2-[(1-aminocarbonylcyclopentyl)carbonyl-(4-carbamimidoylphenyl)amino]propanoate

Systemtic Name: pyridin-3-yl 2-[(1-aminocarbonylcyclopentyl)carbonyl-(4-carbamimidoylphenyl)amino]propanoate Openeye Name: 3-pyridyl 2-(4-carbamimidoyl-N-(1-carbamoylcyclopentanecarbonyl)anilino)propanoate CAS Name: 2-(4-carbamimidoyl-N-[(1-carbamoylcyclopentyl)-oxomethyl]anilino)propanoic acid 3-pyridinyl ester IUPAC Name: pyridin-3-yl 2-(4-carbamimidoyl-N-(1-carbamoylcyclopentanecarbonyl)anilino)propanoate Traditional Name: 2-(4-amidino-N-(1-carbamoylcyclopentanecarbonyl)anilino)propionic acid 3-pyridyl ester Formula: C22H25N5O4 MolecularWeight: 423.465

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1=CN=CC=C1)N(C2=CC=C(C=C2)C(=N)N)C(=O)C3(CCCC3)C(=O)N

Isomeric SMILES

CC(C(=O)OC1=CN=CC=C1)N(C2=CC=C(C=C2)C(=N)N)C(=O)C3(CCCC3)C(=O)N

InChI

InChI=1S/C22H25N5O4/c1-14(19(28)31-17-5-4-12-26-13-17)27(16-8-6-15(7-9-16)18(23)24)21(30)22(20(25)29)10-2-3-11-22/h4-9,12-14H,2-3,10-11H2,1H3,(H3,23,24)(H2,25,29)