ethyl (2S,3R)-2-[bis(methylsulfanyl)methylideneamino]-5-oxidanylidene-3-phenyl-hexanoate

Systemtic Name: ethyl (2S,3R)-2-[bis(methylsulfanyl)methylideneamino]-5-oxidanylidene-3-phenyl-hexanoate Openeye Name: ethyl (2S,3R)-2-[bis(methylsulfanyl)methyleneamino]-5-oxo-3-phenyl-hexanoate CAS Name: (2S,3R)-2-[bis(methylthio)methylideneamino]-5-oxo-3-phenylhexanoic acid ethyl ester IUPAC Name: ethyl (2S,3R)-2-[bis(methylsulfanyl)methylideneamino]-5-oxo-3-phenylhexanoate Traditional Name: (2S,3R)-2-[bis(methylthio)methyleneamino]-5-keto-3-phenyl-hexanoic acid ethyl ester Formula: C17H23NO3S2 MolecularWeight: 353.49942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(CC(=O)C)C1=CC=CC=C1)N=C(SC)SC

Isomeric SMILES

CCOC(=O)[C@H]([C@H](CC(=O)C)C1=CC=CC=C1)N=C(SC)SC

InChI

InChI=1S/C17H23NO3S2/c1-5-21-16(20)15(18-17(22-3)23-4)14(11-12(2)19)13-9-7-6-8-10-13/h6-10,14-15H,5,11H2,1-4H3/t14-,15+/m1/s1