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

Systemtic Name: 3-[4-[4-(2-carbamimidoylphenyl)-1,3-thiazol-2-yl]phenyl]propanoic acid Openeye Name: 3-[4-[4-(2-carbamimidoylphenyl)thiazol-2-yl]phenyl]propanoic acid CAS Name: 3-[4-[4-(2-carbamimidoylphenyl)-2-thiazolyl]phenyl]propanoic acid IUPAC Name: 3-[4-[4-(2-carbamimidoylphenyl)-1,3-thiazol-2-yl]phenyl]propanoic acid Traditional Name: 3-[4-[4-(2-amidinophenyl)thiazol-2-yl]phenyl]propionic acid Formula: C19H17N3O2S MolecularWeight: 351.42218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CSC(=N2)C3=CC=C(C=C3)CCC(=O)O)C(=N)N

Isomeric SMILES

C1=CC=C(C(=C1)C2=CSC(=N2)C3=CC=C(C=C3)CCC(=O)O)C(=N)N

InChI

InChI=1S/C19H17N3O2S/c20-18(21)15-4-2-1-3-14(15)16-11-25-19(22-16)13-8-5-12(6-9-13)7-10-17(23)24/h1-6,8-9,11H,7,10H2,(H3,20,21)(H,23,24)