3-[2-[1-(5-carbamimidoylpyridin-2-yl)piperidin-4-yl]-1,3-thiazol-4-yl]propanoic acid

Systemtic Name: 3-[2-[1-(5-carbamimidoylpyridin-2-yl)piperidin-4-yl]-1,3-thiazol-4-yl]propanoic acid Openeye Name: 3-[2-[1-(5-carbamimidoyl-2-pyridyl)-4-piperidyl]thiazol-4-yl]propanoic acid CAS Name: 3-[2-[1-(5-carbamimidoyl-2-pyridinyl)-4-piperidinyl]-4-thiazolyl]propanoic acid IUPAC Name: 3-[2-[1-(5-carbamimidoylpyridin-2-yl)piperidin-4-yl]-1,3-thiazol-4-yl]propanoic acid Traditional Name: 3-[2-[1-(5-amidino-2-pyridyl)-4-piperidyl]thiazol-4-yl]propionic acid Formula: C17H21N5O2S MolecularWeight: 359.44594

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=CS2)CCC(=O)O)C3=NC=C(C=C3)C(=N)N

Isomeric SMILES

C1CN(CCC1C2=NC(=CS2)CCC(=O)O)C3=NC=C(C=C3)C(=N)N

InChI

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