2-[4-[[4-(4-carbamimidoylphenyl)-1,3-thiazol-2-yl]amino]piperidin-1-yl]-2-phenyl-ethanoic acid

Systemtic Name: 2-[4-[[4-(4-carbamimidoylphenyl)-1,3-thiazol-2-yl]amino]piperidin-1-yl]-2-phenyl-ethanoic acid Openeye Name: 2-[4-[[4-(4-carbamimidoylphenyl)thiazol-2-yl]amino]-1-piperidyl]-2-phenyl-acetic acid CAS Name: 2-[4-[[4-(4-carbamimidoylphenyl)-2-thiazolyl]amino]-1-piperidinyl]-2-phenylacetic acid IUPAC Name: 2-[4-[[4-(4-carbamimidoylphenyl)-1,3-thiazol-2-yl]amino]piperidin-1-yl]-2-phenylacetic acid Traditional Name: 2-[4-[[4-(4-amidinophenyl)thiazol-2-yl]amino]piperidino]-2-phenyl-acetic acid Formula: C23H25N5O2S MolecularWeight: 435.5419

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2=NC(=CS2)C3=CC=C(C=C3)C(=N)N)C(C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CN(CCC1NC2=NC(=CS2)C3=CC=C(C=C3)C(=N)N)C(C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C23H25N5O2S/c24-21(25)17-8-6-15(7-9-17)19-14-31-23(27-19)26-18-10-12-28(13-11-18)20(22(29)30)16-4-2-1-3-5-16/h1-9,14,18,20H,10-13H2,(H3,24,25)(H,26,27)(H,29,30)