S-[(E)-5-phenylsulfanylpent-4-enyl] 2-prop-2-enylbenzenecarbothioate

Systemtic Name: S-[(E)-5-phenylsulfanylpent-4-enyl] 2-prop-2-enylbenzenecarbothioate Openeye Name: S-[(E)-5-phenylsulfanylpent-4-enyl] 2-allylbenzenecarbothioate CAS Name: 2-prop-2-enylbenzenecarbothioic acid S-[(E)-5-(phenylthio)pent-4-enyl] ester IUPAC Name: S-[(E)-5-phenylsulfanylpent-4-enyl] 2-prop-2-enylbenzenecarbothioate Traditional Name: 2-allylthiobenzoic acid S-[(E)-5-(phenylthio)pent-4-enyl] ester Formula: C21H22OS2 MolecularWeight: 354.52878

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC=C1C(=O)SCCCC=CSC2=CC=CC=C2

Isomeric SMILES

C=CCC1=CC=CC=C1C(=O)SCCC/C=C/SC2=CC=CC=C2

InChI

InChI=1S/C21H22OS2/c1-2-11-18-12-7-8-15-20(18)21(22)24-17-10-4-9-16-23-19-13-5-3-6-14-19/h2-3,5-9,12-16H,1,4,10-11,17H2/b16-9+