3-[4-[4-(4-carbamimidoylphenyl)phenyl]-5-methyl-1,3-thiazol-2-yl]propanoic acid

Systemtic Name: 3-[4-[4-(4-carbamimidoylphenyl)phenyl]-5-methyl-1,3-thiazol-2-yl]propanoic acid Openeye Name: 3-[4-[4-(4-carbamimidoylphenyl)phenyl]-5-methyl-thiazol-2-yl]propanoic acid CAS Name: 3-[4-[4-(4-carbamimidoylphenyl)phenyl]-5-methyl-2-thiazolyl]propanoic acid IUPAC Name: 3-[4-[4-(4-carbamimidoylphenyl)phenyl]-5-methyl-1,3-thiazol-2-yl]propanoic acid Traditional Name: 3-[4-[4-(4-amidinophenyl)phenyl]-5-methyl-thiazol-2-yl]propionic acid Formula: C20H19N3O2S MolecularWeight: 365.44876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)CCC(=O)O)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC1=C(N=C(S1)CCC(=O)O)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C20H19N3O2S/c1-12-19(23-17(26-12)10-11-18(24)25)15-6-2-13(3-7-15)14-4-8-16(9-5-14)20(21)22/h2-9H,10-11H2,1H3,(H3,21,22)(H,24,25)