(2R)-4-(4-bromophenyl)-2-(3-methylphenyl)sulfanyl-4-oxidanylidene-butanoate

Systemtic Name: (2R)-4-(4-bromophenyl)-2-(3-methylphenyl)sulfanyl-4-oxidanylidene-butanoate Openeye Name: (2R)-4-(4-bromophenyl)-2-(m-tolylsulfanyl)-4-oxo-butanoate CAS Name: (2R)-4-(4-bromophenyl)-2-[(3-methylphenyl)thio]-4-oxobutanoate IUPAC Name: (2R)-4-(4-bromophenyl)-2-(3-methylphenyl)sulfanyl-4-oxobutanoate Traditional Name: (2R)-4-(4-bromophenyl)-4-keto-2-(m-tolylthio)butyrate Formula: C17H14BrO3S- MolecularWeight: 378.26026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)SC(CC(=O)C2=CC=C(C=C2)Br)C(=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)S[C@H](CC(=O)C2=CC=C(C=C2)Br)C(=O)[O-]

InChI

InChI=1S/C17H15BrO3S/c1-11-3-2-4-14(9-11)22-16(17(20)21)10-15(19)12-5-7-13(18)8-6-12/h2-9,16H,10H2,1H3,(H,20,21)/p-1/t16-/m1/s1