2-[2-(furan-2-ylmethylamino)-4-phenyl-1,3-thiazol-5-yl]ethanoic acid

Systemtic Name: 2-[2-(furan-2-ylmethylamino)-4-phenyl-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-[2-(2-furylmethylamino)-4-phenyl-thiazol-5-yl]acetic acid CAS Name: 2-[2-(2-furanylmethylamino)-4-phenyl-5-thiazolyl]acetic acid IUPAC Name: 2-[2-(furan-2-ylmethylamino)-4-phenyl-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-[2-(2-furfurylamino)-4-phenyl-thiazol-5-yl]acetic acid Formula: C16H14N2O3S MolecularWeight: 314.35896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(SC(=N2)NCC3=CC=CO3)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(SC(=N2)NCC3=CC=CO3)CC(=O)O

InChI

InChI=1S/C16H14N2O3S/c19-14(20)9-13-15(11-5-2-1-3-6-11)18-16(22-13)17-10-12-7-4-8-21-12/h1-8H,9-10H2,(H,17,18)(H,19,20)