S-[4-[3-oxidanylidene-6-(2-phenylethynyl)indol-2-yl]phenyl] ethanethioate

Systemtic Name: S-[4-[3-oxidanylidene-6-(2-phenylethynyl)indol-2-yl]phenyl] ethanethioate Openeye Name: S-[4-[3-oxo-6-(2-phenylethynyl)indol-2-yl]phenyl] ethanethioate CAS Name: ethanethioic acid S-[4-[3-oxo-6-(2-phenylethynyl)-2-indolyl]phenyl] ester IUPAC Name: S-[4-[3-oxo-6-(2-phenylethynyl)indol-2-yl]phenyl] ethanethioate Traditional Name: ethanethioic acid S-[4-[3-keto-6-(2-phenylethynyl)indol-2-yl]phenyl] ester Formula: C24H15NO2S MolecularWeight: 381.4464

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1=CC=C(C=C1)C2=NC3=C(C2=O)C=CC(=C3)C#CC4=CC=CC=C4

Isomeric SMILES

CC(=O)SC1=CC=C(C=C1)C2=NC3=C(C2=O)C=CC(=C3)C#CC4=CC=CC=C4

InChI

InChI=1S/C24H15NO2S/c1-16(26)28-20-12-10-19(11-13-20)23-24(27)21-14-9-18(15-22(21)25-23)8-7-17-5-3-2-4-6-17/h2-6,9-15H,1H3