S-(4-chlorophenyl) 3,5,7-trimethyl-1-benzofuran-2-carbothioate

Systemtic Name: S-(4-chlorophenyl) 3,5,7-trimethyl-1-benzofuran-2-carbothioate Openeye Name: S-(4-chlorophenyl) 3,5,7-trimethylbenzofuran-2-carbothioate CAS Name: 3,5,7-trimethyl-2-benzofurancarbothioic acid S-(4-chlorophenyl) ester IUPAC Name: S-(4-chlorophenyl) 3,5,7-trimethyl-1-benzofuran-2-carbothioate Traditional Name: 3,5,7-trimethylbenzofuran-2-carbothioic acid S-(4-chlorophenyl) ester Formula: C18H15ClO2S MolecularWeight: 330.8285

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=C(O2)C(=O)SC3=CC=C(C=C3)Cl)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=C(O2)C(=O)SC3=CC=C(C=C3)Cl)C)C

InChI

InChI=1S/C18H15ClO2S/c1-10-8-11(2)16-15(9-10)12(3)17(21-16)18(20)22-14-6-4-13(19)5-7-14/h4-9H,1-3H3