1-(3-methylsulfanylindol-1-yl)propan-2-one

Systemtic Name: 1-(3-methylsulfanylindol-1-yl)propan-2-one Openeye Name: 1-(3-methylsulfanylindol-1-yl)propan-2-one CAS Name: 1-[3-(methylthio)-1-indolyl]-2-propanone IUPAC Name: 1-(3-methylsulfanylindol-1-yl)propan-2-one Traditional Name: 1-[3-(methylthio)indol-1-yl]acetone Formula: C12H13NOS MolecularWeight: 219.30272

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN1C=C(C2=CC=CC=C21)SC

Isomeric SMILES

CC(=O)CN1C=C(C2=CC=CC=C21)SC

InChI

InChI=1S/C12H13NOS/c1-9(14)7-13-8-12(15-2)10-5-3-4-6-11(10)13/h3-6,8H,7H2,1-2H3