2-[2-[2-[(4-butoxy-3-methoxy-phenyl)methylamino]-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-[2-[(4-butoxy-3-methoxy-phenyl)methylamino]-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[2-[(4-butoxy-3-methoxy-phenyl)methylamino]-2-oxo-ethyl]thiazol-4-yl]acetic acid CAS Name: 2-[2-[2-[(4-butoxy-3-methoxyphenyl)methylamino]-2-oxoethyl]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[2-[(4-butoxy-3-methoxyphenyl)methylamino]-2-oxoethyl]-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[2-[(4-butoxy-3-methoxy-benzyl)amino]-2-keto-ethyl]thiazol-4-yl]acetic acid Formula: C19H24N2O5S MolecularWeight: 392.46926

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CNC(=O)CC2=NC(=CS2)CC(=O)O)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CNC(=O)CC2=NC(=CS2)CC(=O)O)OC

InChI

InChI=1S/C19H24N2O5S/c1-3-4-7-26-15-6-5-13(8-16(15)25-2)11-20-17(22)10-18-21-14(12-27-18)9-19(23)24/h5-6,8,12H,3-4,7,9-11H2,1-2H3,(H,20,22)(H,23,24)