ethyl 4-[(E)-2-[4-(3-methyl-2-sulfanylidene-but-3-enyl)phenyl]ethenyl]benzoate

Systemtic Name: ethyl 4-[(E)-2-[4-(3-methyl-2-sulfanylidene-but-3-enyl)phenyl]ethenyl]benzoate Openeye Name: ethyl 4-[(E)-2-[4-(3-methyl-2-thioxo-but-3-enyl)phenyl]vinyl]benzoate CAS Name: 4-[(E)-2-[4-(3-methyl-2-sulfanylidenebut-3-enyl)phenyl]ethenyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(E)-2-[4-(3-methyl-2-sulfanylidenebut-3-enyl)phenyl]ethenyl]benzoate Traditional Name: 4-[(E)-2-[4-(3-methyl-2-thioxo-but-3-enyl)phenyl]vinyl]benzoic acid ethyl ester Formula: C22H22O2S MolecularWeight: 350.47388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C=CC2=CC=C(C=C2)CC(=S)C(=C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)CC(=S)C(=C)C

InChI

InChI=1S/C22H22O2S/c1-4-24-22(23)20-13-11-18(12-14-20)6-5-17-7-9-19(10-8-17)15-21(25)16(2)3/h5-14H,2,4,15H2,1,3H3/b6-5+