S-(4-methoxyphenyl) 4-butylbenzenecarbothioate

Systemtic Name: S-(4-methoxyphenyl) 4-butylbenzenecarbothioate Openeye Name: S-(4-methoxyphenyl) 4-butylbenzenecarbothioate CAS Name: 4-butylbenzenecarbothioic acid S-(4-methoxyphenyl) ester IUPAC Name: S-(4-methoxyphenyl) 4-butylbenzenecarbothioate Traditional Name: 4-butylthiobenzoic acid S-(4-methoxyphenyl) ester Formula: C18H20O2S MolecularWeight: 300.4152

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)SC2=CC=C(C=C2)OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)SC2=CC=C(C=C2)OC

InChI

InChI=1S/C18H20O2S/c1-3-4-5-14-6-8-15(9-7-14)18(19)21-17-12-10-16(20-2)11-13-17/h6-13H,3-5H2,1-2H3