3-(3-azanyl-1-benzofuran-2-yl)propanoyl 3-ethanoylsulfanyl-2-methyl-propanoate

Systemtic Name: 3-(3-azanyl-1-benzofuran-2-yl)propanoyl 3-ethanoylsulfanyl-2-methyl-propanoate Openeye Name: 3-(3-aminobenzofuran-2-yl)propanoyl 3-acetylsulfanyl-2-methyl-propanoate CAS Name: 3-(acetylthio)-2-methylpropanoic acid [3-(3-amino-2-benzofuranyl)-1-oxopropyl] ester IUPAC Name: 3-(3-amino-1-benzofuran-2-yl)propanoyl 3-acetylsulfanyl-2-methylpropanoate Traditional Name: 3-(acetylthio)-2-methyl-propionic acid 3-(3-aminobenzofuran-2-yl)propanoyl ester Formula: C17H19NO5S MolecularWeight: 349.40146

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)C(=O)OC(=O)CCC1=C(C2=CC=CC=C2O1)N

Isomeric SMILES

CC(CSC(=O)C)C(=O)OC(=O)CCC1=C(C2=CC=CC=C2O1)N

InChI

InChI=1S/C17H19NO5S/c1-10(9-24-11(2)19)17(21)23-15(20)8-7-14-16(18)12-5-3-4-6-13(12)22-14/h3-6,10H,7-9,18H2,1-2H3