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

Systemtic Name: 3-bromanyl-4-butylsulfanyl-2,5-dimethyl-1-phenyl-pyrrole Openeye Name: 3-bromo-4-butylsulfanyl-2,5-dimethyl-1-phenyl-pyrrole CAS Name: 3-bromo-4-(butylthio)-2,5-dimethyl-1-phenylpyrrole IUPAC Name: 3-bromo-4-butylsulfanyl-2,5-dimethyl-1-phenylpyrrole Traditional Name: 3-bromo-4-(butylthio)-2,5-dimethyl-1-phenyl-pyrrole Formula: C16H20BrNS MolecularWeight: 338.3057

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=C(N(C(=C1Br)C)C2=CC=CC=C2)C

Isomeric SMILES

CCCCSC1=C(N(C(=C1Br)C)C2=CC=CC=C2)C

InChI

InChI=1S/C16H20BrNS/c1-4-5-11-19-16-13(3)18(12(2)15(16)17)14-9-7-6-8-10-14/h6-10H,4-5,11H2,1-3H3