methyl 2-(4-bromophenyl)-2-(2-methylphenyl)sulfanyl-pent-4-enoate

Systemtic Name: methyl 2-(4-bromophenyl)-2-(2-methylphenyl)sulfanyl-pent-4-enoate Openeye Name: methyl 2-(4-bromophenyl)-2-(o-tolylsulfanyl)pent-4-enoate CAS Name: 2-(4-bromophenyl)-2-[(2-methylphenyl)thio]-4-pentenoic acid methyl ester IUPAC Name: methyl 2-(4-bromophenyl)-2-(2-methylphenyl)sulfanylpent-4-enoate Traditional Name: 2-(4-bromophenyl)-2-(o-tolylthio)pent-4-enoic acid methyl ester Formula: C19H19BrO2S MolecularWeight: 391.32196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SC(CC=C)(C2=CC=C(C=C2)Br)C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1SC(CC=C)(C2=CC=C(C=C2)Br)C(=O)OC

InChI

InChI=1S/C19H19BrO2S/c1-4-13-19(18(21)22-3,15-9-11-16(20)12-10-15)23-17-8-6-5-7-14(17)2/h4-12H,1,13H2,2-3H3