methyl 4-[(E)-1-(4-fluorophenyl)sulfanyl-4-phenyl-but-3-enyl]benzoate

Systemtic Name: methyl 4-[(E)-1-(4-fluorophenyl)sulfanyl-4-phenyl-but-3-enyl]benzoate Openeye Name: methyl 4-[(E)-1-(4-fluorophenyl)sulfanyl-4-phenyl-but-3-enyl]benzoate CAS Name: 4-[(E)-1-[(4-fluorophenyl)thio]-4-phenylbut-3-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-1-(4-fluorophenyl)sulfanyl-4-phenylbut-3-enyl]benzoate Traditional Name: 4-[(E)-1-[(4-fluorophenyl)thio]-4-phenyl-but-3-enyl]benzoic acid methyl ester Formula: C24H21FO2S MolecularWeight: 392.485743

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(CC=CC2=CC=CC=C2)SC3=CC=C(C=C3)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(C/C=C/C2=CC=CC=C2)SC3=CC=C(C=C3)F

InChI

InChI=1S/C24H21FO2S/c1-27-24(26)20-12-10-19(11-13-20)23(28-22-16-14-21(25)15-17-22)9-5-8-18-6-3-2-4-7-18/h2-8,10-17,23H,9H2,1H3/b8-5+