methyl 2-[2-[(Z)-1-azanyl-2-methylsulfanyl-2-(2-oxidanyl-2-phenyl-ethyl)sulfanyl-ethenyl]phenyl]ethanoate

Systemtic Name: methyl 2-[2-[(Z)-1-azanyl-2-methylsulfanyl-2-(2-oxidanyl-2-phenyl-ethyl)sulfanyl-ethenyl]phenyl]ethanoate Openeye Name: methyl 2-[2-[(Z)-1-amino-2-(2-hydroxy-2-phenyl-ethyl)sulfanyl-2-methylsulfanyl-vinyl]phenyl]acetate CAS Name: 2-[2-[(Z)-1-amino-2-[(2-hydroxy-2-phenylethyl)thio]-2-(methylthio)ethenyl]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(Z)-1-amino-2-(2-hydroxy-2-phenylethyl)sulfanyl-2-methylsulfanylethenyl]phenyl]acetate Traditional Name: 2-[2-[(Z)-1-amino-2-[(2-hydroxy-2-phenyl-ethyl)thio]-2-(methylthio)vinyl]phenyl]acetic acid methyl ester Formula: C20H23NO3S2 MolecularWeight: 389.53152

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC=CC=C1C(=C(SC)SCC(C2=CC=CC=C2)O)N

Isomeric SMILES

COC(=O)CC1=CC=CC=C1/C(=C(\SC)/SCC(C2=CC=CC=C2)O)/N

InChI

InChI=1S/C20H23NO3S2/c1-24-18(23)12-15-10-6-7-11-16(15)19(21)20(25-2)26-13-17(22)14-8-4-3-5-9-14/h3-11,17,22H,12-13,21H2,1-2H3/b20-19-