4-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-(oxolan-2-ylmethyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-(oxolan-2-ylmethyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[4-(4-methoxyphenyl)thiazol-2-yl]-(tetrahydrofuran-2-ylmethyl)amino]-4-oxo-butanoic acid CAS Name: 4-[[4-(4-methoxyphenyl)-2-thiazolyl]-(2-oxolanylmethyl)amino]-4-oxobutanoic acid IUPAC Name: 4-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-(oxolan-2-ylmethyl)amino]-4-oxobutanoic acid Traditional Name: 4-keto-4-[[4-(4-methoxyphenyl)thiazol-2-yl]-(tetrahydrofurfuryl)amino]butyric acid Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=N2)N(CC3CCCO3)C(=O)CCC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=N2)N(CC3CCCO3)C(=O)CCC(=O)O

InChI

InChI=1S/C19H22N2O5S/c1-25-14-6-4-13(5-7-14)16-12-27-19(20-16)21(11-15-3-2-10-26-15)17(22)8-9-18(23)24/h4-7,12,15H,2-3,8-11H2,1H3,(H,23,24)