S-[2-(1H-indol-3-yl)ethanoyl] benzenecarbothioate

Systemtic Name: S-[2-(1H-indol-3-yl)ethanoyl] benzenecarbothioate Openeye Name: S-[2-(1H-indol-3-yl)acetyl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[2-(1H-indol-3-yl)-1-oxoethyl] ester IUPAC Name: S-[2-(1H-indol-3-yl)acetyl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[2-(1H-indol-3-yl)acetyl] ester Formula: C17H13NO2S MolecularWeight: 295.35562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)SC(=O)CC2=CNC3=CC=CC=C32

Isomeric SMILES

C1=CC=C(C=C1)C(=O)SC(=O)CC2=CNC3=CC=CC=C32

InChI

InChI=1S/C17H13NO2S/c19-16(21-17(20)12-6-2-1-3-7-12)10-13-11-18-15-9-5-4-8-14(13)15/h1-9,11,18H,10H2