[2-(cyclopropylamino)-2-oxidanylidene-ethyl] 2-(4-bromophenyl)sulfanylethanoate

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-ethyl] 2-(4-bromophenyl)sulfanylethanoate Openeye Name: [2-(cyclopropylamino)-2-oxo-ethyl] 2-(4-bromophenyl)sulfanylacetate CAS Name: 2-[(4-bromophenyl)thio]acetic acid [2-(cyclopropylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxoethyl] 2-(4-bromophenyl)sulfanylacetate Traditional Name: 2-[(4-bromophenyl)thio]acetic acid [2-(cyclopropylamino)-2-keto-ethyl] ester Formula: C13H14BrNO3S MolecularWeight: 344.22416

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)COC(=O)CSC2=CC=C(C=C2)Br

Isomeric SMILES

C1CC1NC(=O)COC(=O)CSC2=CC=C(C=C2)Br

InChI

InChI=1S/C13H14BrNO3S/c14-9-1-5-11(6-2-9)19-8-13(17)18-7-12(16)15-10-3-4-10/h1-2,5-6,10H,3-4,7-8H2,(H,15,16)