S-methyl 3-methoxy-2-propyl-benzenecarbothioate

Systemtic Name: S-methyl 3-methoxy-2-propyl-benzenecarbothioate Openeye Name: S-methyl 3-methoxy-2-propyl-benzenecarbothioate CAS Name: 3-methoxy-2-propylbenzenecarbothioic acid S-methyl ester IUPAC Name: S-methyl 3-methoxy-2-propylbenzenecarbothioate Traditional Name: 3-methoxy-2-propyl-thiobenzoic acid S-methyl ester Formula: C12H16O2S MolecularWeight: 224.31924

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC=C1OC)C(=O)SC

Isomeric SMILES

CCCC1=C(C=CC=C1OC)C(=O)SC

InChI

InChI=1S/C12H16O2S/c1-4-6-9-10(12(13)15-3)7-5-8-11(9)14-2/h5,7-8H,4,6H2,1-3H3