3-methyl-4-(phenylmethylsulfanyl)-1H-indole-6,7-diol

Systemtic Name: 3-methyl-4-(phenylmethylsulfanyl)-1H-indole-6,7-diol Openeye Name: 4-benzylsulfanyl-3-methyl-1H-indole-6,7-diol CAS Name: 3-methyl-4-(phenylmethylthio)-1H-indole-6,7-diol IUPAC Name: 4-benzylsulfanyl-3-methyl-1H-indole-6,7-diol Traditional Name: 4-(benzylthio)-3-methyl-1H-indole-6,7-diol Formula: C16H15NO2S MolecularWeight: 285.3608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CNC2=C(C(=CC(=C12)SCC3=CC=CC=C3)O)O

Isomeric SMILES

CC1=CNC2=C(C(=CC(=C12)SCC3=CC=CC=C3)O)O

InChI

InChI=1S/C16H15NO2S/c1-10-8-17-15-14(10)13(7-12(18)16(15)19)20-9-11-5-3-2-4-6-11/h2-8,17-19H,9H2,1H3