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

Systemtic Name: 3-[4-[[4-(4-carbamimidoylphenyl)-1,3-thiazol-2-yl]amino]piperidin-1-yl]propanoic acid Openeye Name: 3-[4-[[4-(4-carbamimidoylphenyl)thiazol-2-yl]amino]-1-piperidyl]propanoic acid CAS Name: 3-[4-[[4-(4-carbamimidoylphenyl)-2-thiazolyl]amino]-1-piperidinyl]propanoic acid IUPAC Name: 3-[4-[[4-(4-carbamimidoylphenyl)-1,3-thiazol-2-yl]amino]piperidin-1-yl]propanoic acid Traditional Name: 3-[4-[[4-(4-amidinophenyl)thiazol-2-yl]amino]piperidino]propionic acid Formula: C18H23N5O2S MolecularWeight: 373.47252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N5O2S/c19-17(20)13-3-1-12(2-4-13)15-11-26-18(22-15)21-14-5-8-23(9-6-14)10-7-16(24)25/h1-4,11,14H,5-10H2,(H3,19,20)(H,21,22)(H,24,25)