S-[3-(5-bromanyl-1H-indol-3-yl)-2-oxidanylidene-propyl] ethanethioate

Systemtic Name: S-[3-(5-bromanyl-1H-indol-3-yl)-2-oxidanylidene-propyl] ethanethioate Openeye Name: S-[3-(5-bromo-1H-indol-3-yl)-2-oxo-propyl] ethanethioate CAS Name: ethanethioic acid S-[3-(5-bromo-1H-indol-3-yl)-2-oxopropyl] ester IUPAC Name: S-[3-(5-bromo-1H-indol-3-yl)-2-oxopropyl] ethanethioate Traditional Name: ethanethioic acid S-[3-(5-bromo-1H-indol-3-yl)-2-keto-propyl] ester Formula: C13H12BrNO2S MolecularWeight: 326.20888

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)CC1=CNC2=C1C=C(C=C2)Br

Isomeric SMILES

CC(=O)SCC(=O)CC1=CNC2=C1C=C(C=C2)Br

InChI

InChI=1S/C13H12BrNO2S/c1-8(16)18-7-11(17)4-9-6-15-13-3-2-10(14)5-12(9)13/h2-3,5-6,15H,4,7H2,1H3