ethyl (2R)-2-[[5-[(3,4-dimethylphenoxy)methyl]furan-2-yl]carbonylamino]-3-sulfanyl-propanoate

Systemtic Name: ethyl (2R)-2-[[5-[(3,4-dimethylphenoxy)methyl]furan-2-yl]carbonylamino]-3-sulfanyl-propanoate Openeye Name: ethyl (2R)-2-[[5-[(3,4-dimethylphenoxy)methyl]furan-2-carbonyl]amino]-3-sulfanyl-propanoate CAS Name: (2R)-2-[[[5-[(3,4-dimethylphenoxy)methyl]-2-furanyl]-oxomethyl]amino]-3-mercaptopropanoic acid ethyl ester IUPAC Name: ethyl (2R)-2-[[5-[(3,4-dimethylphenoxy)methyl]furan-2-carbonyl]amino]-3-sulfanylpropanoate Traditional Name: (2R)-2-[[5-[(3,4-dimethylphenoxy)methyl]-2-furoyl]amino]-3-mercapto-propionic acid ethyl ester Formula: C19H23NO5S MolecularWeight: 377.45462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CS)NC(=O)C1=CC=C(O1)COC2=CC(=C(C=C2)C)C

Isomeric SMILES

CCOC(=O)[C@H](CS)NC(=O)C1=CC=C(O1)COC2=CC(=C(C=C2)C)C

InChI

InChI=1S/C19H23NO5S/c1-4-23-19(22)16(11-26)20-18(21)17-8-7-15(25-17)10-24-14-6-5-12(2)13(3)9-14/h5-9,16,26H,4,10-11H2,1-3H3,(H,20,21)/t16-/m0/s1