S-[(1,2-dimethylindol-3-yl)methyl] ethanethioate

Systemtic Name: S-[(1,2-dimethylindol-3-yl)methyl] ethanethioate Openeye Name: S-[(1,2-dimethylindol-3-yl)methyl] ethanethioate CAS Name: ethanethioic acid S-[(1,2-dimethyl-3-indolyl)methyl] ester IUPAC Name: S-[(1,2-dimethylindol-3-yl)methyl] ethanethioate Traditional Name: ethanethioic acid S-[(1,2-dimethylindol-3-yl)methyl] ester Formula: C13H15NOS MolecularWeight: 233.3293

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1C)CSC(=O)C

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1C)CSC(=O)C

InChI

InChI=1S/C13H15NOS/c1-9-12(8-16-10(2)15)11-6-4-5-7-13(11)14(9)3/h4-7H,8H2,1-3H3