2-(7-methoxy-1H-indol-3-yl)-2,2-bis(methylsulfanyl)ethanenitrile

Systemtic Name: 2-(7-methoxy-1H-indol-3-yl)-2,2-bis(methylsulfanyl)ethanenitrile Openeye Name: 2-(7-methoxy-1H-indol-3-yl)-2,2-bis(methylsulfanyl)acetonitrile CAS Name: 2-(7-methoxy-1H-indol-3-yl)-2,2-bis(methylthio)acetonitrile IUPAC Name: 2-(7-methoxy-1H-indol-3-yl)-2,2-bis(methylsulfanyl)acetonitrile Traditional Name: 2-(7-methoxy-1H-indol-3-yl)-2,2-bis(methylthio)acetonitrile Formula: C13H14N2OS2 MolecularWeight: 278.39306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1NC=C2C(C#N)(SC)SC

Isomeric SMILES

COC1=CC=CC2=C1NC=C2C(C#N)(SC)SC

InChI

InChI=1S/C13H14N2OS2/c1-16-11-6-4-5-9-10(7-15-12(9)11)13(8-14,17-2)18-3/h4-7,15H,1-3H3