methyl 2-[(4-bromanyl-3-ethanethioyl-2,6-dimethyl-phenyl)-propan-2-yl-amino]propanoate

Systemtic Name: methyl 2-[(4-bromanyl-3-ethanethioyl-2,6-dimethyl-phenyl)-propan-2-yl-amino]propanoate Openeye Name: methyl 2-(4-bromo-3-ethanethioyl-N-isopropyl-2,6-dimethyl-anilino)propanoate CAS Name: 2-[4-bromo-2,6-dimethyl-N-propan-2-yl-3-(1-sulfanylideneethyl)anilino]propanoic acid methyl ester IUPAC Name: methyl 2-(4-bromo-3-ethanethioyl-2,6-dimethyl-N-propan-2-ylanilino)propanoate Traditional Name: 2-(4-bromo-N-isopropyl-2,6-dimethyl-3-thioacetyl-anilino)propionic acid methyl ester Formula: C17H24BrNO2S MolecularWeight: 386.34696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1N(C(C)C)C(C)C(=O)OC)C)C(=S)C)Br

Isomeric SMILES

CC1=CC(=C(C(=C1N(C(C)C)C(C)C(=O)OC)C)C(=S)C)Br

InChI

InChI=1S/C17H24BrNO2S/c1-9(2)19(12(5)17(20)21-7)16-10(3)8-14(18)15(11(16)4)13(6)22/h8-9,12H,1-7H3