methyl 2-[[2-(ethanoylsulfanylmethyl)-3-phenyl-propanoyl]-thiophen-2-yl-amino]ethanoate

Systemtic Name: methyl 2-[[2-(ethanoylsulfanylmethyl)-3-phenyl-propanoyl]-thiophen-2-yl-amino]ethanoate Openeye Name: methyl 2-[[2-(acetylsulfanylmethyl)-3-phenyl-propanoyl]-(2-thienyl)amino]acetate CAS Name: 2-[[2-[(acetylthio)methyl]-1-oxo-3-phenylpropyl]-thiophen-2-ylamino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-(acetylsulfanylmethyl)-3-phenylpropanoyl]-thiophen-2-ylamino]acetate Traditional Name: 2-[[2-[(acetylthio)methyl]-3-phenyl-propanoyl]-(2-thienyl)amino]acetic acid methyl ester Formula: C19H21NO4S2 MolecularWeight: 391.50434

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(CC1=CC=CC=C1)C(=O)N(CC(=O)OC)C2=CC=CS2

Isomeric SMILES

CC(=O)SCC(CC1=CC=CC=C1)C(=O)N(CC(=O)OC)C2=CC=CS2

InChI

InChI=1S/C19H21NO4S2/c1-14(21)26-13-16(11-15-7-4-3-5-8-15)19(23)20(12-18(22)24-2)17-9-6-10-25-17/h3-10,16H,11-13H2,1-2H3