3-bromanyl-2,5-dimethyl-4-methylsulfanyl-1-phenyl-pyrrole

Systemtic Name: 3-bromanyl-2,5-dimethyl-4-methylsulfanyl-1-phenyl-pyrrole Openeye Name: 3-bromo-2,5-dimethyl-4-methylsulfanyl-1-phenyl-pyrrole CAS Name: 3-bromo-2,5-dimethyl-4-(methylthio)-1-phenylpyrrole IUPAC Name: 3-bromo-2,5-dimethyl-4-methylsulfanyl-1-phenylpyrrole Traditional Name: 3-bromo-2,5-dimethyl-4-(methylthio)-1-phenyl-pyrrole Formula: C13H14BrNS MolecularWeight: 296.22596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1C2=CC=CC=C2)C)Br)SC

Isomeric SMILES

CC1=C(C(=C(N1C2=CC=CC=C2)C)Br)SC

InChI

InChI=1S/C13H14BrNS/c1-9-12(14)13(16-3)10(2)15(9)11-7-5-4-6-8-11/h4-8H,1-3H3