S-(4-cyanophenyl) 4-(2-methylbutoxy)benzenecarbothioate

Systemtic Name: S-(4-cyanophenyl) 4-(2-methylbutoxy)benzenecarbothioate Openeye Name: S-(4-cyanophenyl) 4-(2-methylbutoxy)benzenecarbothioate CAS Name: 4-(2-methylbutoxy)benzenecarbothioic acid S-(4-cyanophenyl) ester IUPAC Name: S-(4-cyanophenyl) 4-(2-methylbutoxy)benzenecarbothioate Traditional Name: 4-(2-methylbutoxy)thiobenzoic acid S-(4-cyanophenyl) ester Formula: C19H19NO2S MolecularWeight: 325.42466

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)COC1=CC=C(C=C1)C(=O)SC2=CC=C(C=C2)C#N

Isomeric SMILES

CCC(C)COC1=CC=C(C=C1)C(=O)SC2=CC=C(C=C2)C#N

InChI

InChI=1S/C19H19NO2S/c1-3-14(2)13-22-17-8-6-16(7-9-17)19(21)23-18-10-4-15(12-20)5-11-18/h4-11,14H,3,13H2,1-2H3