ethyl 3-bromanyl-4-(2-butylsulfanylethanoylamino)benzoate

Systemtic Name: ethyl 3-bromanyl-4-(2-butylsulfanylethanoylamino)benzoate Openeye Name: ethyl 3-bromo-4-[(2-butylsulfanylacetyl)amino]benzoate CAS Name: 3-bromo-4-[[2-(butylthio)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-bromo-4-[(2-butylsulfanylacetyl)amino]benzoate Traditional Name: 3-bromo-4-[[2-(butylthio)acetyl]amino]benzoic acid ethyl ester Formula: C15H20BrNO3S MolecularWeight: 374.2932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCC(=O)NC1=C(C=C(C=C1)C(=O)OCC)Br

Isomeric SMILES

CCCCSCC(=O)NC1=C(C=C(C=C1)C(=O)OCC)Br

InChI

InChI=1S/C15H20BrNO3S/c1-3-5-8-21-10-14(18)17-13-7-6-11(9-12(13)16)15(19)20-4-2/h6-7,9H,3-5,8,10H2,1-2H3,(H,17,18)