S-(4-ethoxyphenyl) 4-pentylbenzenecarbothioate

Systemtic Name: S-(4-ethoxyphenyl) 4-pentylbenzenecarbothioate Openeye Name: S-(4-ethoxyphenyl) 4-pentylbenzenecarbothioate CAS Name: 4-pentylbenzenecarbothioic acid S-(4-ethoxyphenyl) ester IUPAC Name: S-(4-ethoxyphenyl) 4-pentylbenzenecarbothioate Traditional Name: 4-amylthiobenzoic acid S-p-phenetyl ester Formula: C20H24O2S MolecularWeight: 328.46836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)SC2=CC=C(C=C2)OCC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)SC2=CC=C(C=C2)OCC

InChI

InChI=1S/C20H24O2S/c1-3-5-6-7-16-8-10-17(11-9-16)20(21)23-19-14-12-18(13-15-19)22-4-2/h8-15H,3-7H2,1-2H3