ethyl 2-[2-[2-(phenylmethylsulfanyl)propanoylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[2-(phenylmethylsulfanyl)propanoylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-(2-benzylsulfanylpropanoylamino)thiazol-4-yl]acetate CAS Name: 2-[2-[[1-oxo-2-(phenylmethylthio)propyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(2-benzylsulfanylpropanoylamino)-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[2-(benzylthio)propanoylamino]thiazol-4-yl]acetic acid ethyl ester Formula: C17H20N2O3S2 MolecularWeight: 364.4823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC(=O)C(C)SCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC(=O)C(C)SCC2=CC=CC=C2

InChI

InChI=1S/C17H20N2O3S2/c1-3-22-15(20)9-14-11-24-17(18-14)19-16(21)12(2)23-10-13-7-5-4-6-8-13/h4-8,11-12H,3,9-10H2,1-2H3,(H,18,19,21)