4-(3,3-dimethylbutylsulfanyl)-3-fluoranyl-aniline

Systemtic Name: 4-(3,3-dimethylbutylsulfanyl)-3-fluoranyl-aniline Openeye Name: 4-(3,3-dimethylbutylsulfanyl)-3-fluoro-aniline CAS Name: 4-(3,3-dimethylbutylthio)-3-fluoroaniline IUPAC Name: 4-(3,3-dimethylbutylsulfanyl)-3-fluoroaniline Traditional Name: [4-(3,3-dimethylbutylthio)-3-fluoro-phenyl]amine Formula: C12H18FNS MolecularWeight: 227.341423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCSC1=C(C=C(C=C1)N)F

Isomeric SMILES

CC(C)(C)CCSC1=C(C=C(C=C1)N)F

InChI

InChI=1S/C12H18FNS/c1-12(2,3)6-7-15-11-5-4-9(14)8-10(11)13/h4-5,8H,6-7,14H2,1-3H3