S-phenethyl 4-tert-butylbenzenecarbothioate

Systemtic Name: S-phenethyl 4-tert-butylbenzenecarbothioate Openeye Name: S-phenethyl 4-tert-butylbenzenecarbothioate CAS Name: 4-tert-butylbenzenecarbothioic acid S-phenethyl ester IUPAC Name: S-phenethyl 4-tert-butylbenzenecarbothioate Traditional Name: 4-tert-butylthiobenzoic acid S-phenethyl ester Formula: C19H22OS MolecularWeight: 298.44238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)SCCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)SCCC2=CC=CC=C2

InChI

InChI=1S/C19H22OS/c1-19(2,3)17-11-9-16(10-12-17)18(20)21-14-13-15-7-5-4-6-8-15/h4-12H,13-14H2,1-3H3