methyl 2-(2,6-dimethylphenyl)sulfanyl-2-phenyl-pent-4-enoate

Systemtic Name: methyl 2-(2,6-dimethylphenyl)sulfanyl-2-phenyl-pent-4-enoate Openeye Name: methyl 2-(2,6-dimethylphenyl)sulfanyl-2-phenyl-pent-4-enoate CAS Name: 2-[(2,6-dimethylphenyl)thio]-2-phenyl-4-pentenoic acid methyl ester IUPAC Name: methyl 2-(2,6-dimethylphenyl)sulfanyl-2-phenylpent-4-enoate Traditional Name: 2-[(2,6-dimethylphenyl)thio]-2-phenyl-pent-4-enoic acid methyl ester Formula: C20H22O2S MolecularWeight: 326.45248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)SC(CC=C)(C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)SC(CC=C)(C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C20H22O2S/c1-5-14-20(19(21)22-4,17-12-7-6-8-13-17)23-18-15(2)10-9-11-16(18)3/h5-13H,1,14H2,2-4H3