2-[3,4-bis(methylsulfanyl)pyrrol-1-yl]phenol

Systemtic Name: 2-[3,4-bis(methylsulfanyl)pyrrol-1-yl]phenol Openeye Name: 2-[3,4-bis(methylsulfanyl)pyrrol-1-yl]phenol CAS Name: 2-[3,4-bis(methylthio)-1-pyrrolyl]phenol IUPAC Name: 2-[3,4-bis(methylsulfanyl)pyrrol-1-yl]phenol Traditional Name: 2-[3,4-bis(methylthio)pyrrol-1-yl]phenol Formula: C12H13NOS2 MolecularWeight: 251.36772

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CN(C=C1SC)C2=CC=CC=C2O

Isomeric SMILES

CSC1=CN(C=C1SC)C2=CC=CC=C2O

InChI

InChI=1S/C12H13NOS2/c1-15-11-7-13(8-12(11)16-2)9-5-3-4-6-10(9)14/h3-8,14H,1-2H3