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

Systemtic Name: 2-[4-[[4-(4-carbamimidoylphenyl)-1,3-thiazol-2-yl]amino]piperidin-1-yl]ethanoic acid Openeye Name: 2-[4-[[4-(4-carbamimidoylphenyl)thiazol-2-yl]amino]-1-piperidyl]acetic acid CAS Name: 2-[4-[[4-(4-carbamimidoylphenyl)-2-thiazolyl]amino]-1-piperidinyl]acetic acid IUPAC Name: 2-[4-[[4-(4-carbamimidoylphenyl)-1,3-thiazol-2-yl]amino]piperidin-1-yl]acetic acid Traditional Name: 2-[4-[[4-(4-amidinophenyl)thiazol-2-yl]amino]piperidino]acetic acid Formula: C17H21N5O2S MolecularWeight: 359.44594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N5O2S/c18-16(19)12-3-1-11(2-4-12)14-10-25-17(21-14)20-13-5-7-22(8-6-13)9-15(23)24/h1-4,10,13H,5-9H2,(H3,18,19)(H,20,21)(H,23,24)