4-[3-(2,5-dimethylphenoxy)propylsulfanyl]-3-fluoranyl-aniline

Systemtic Name: 4-[3-(2,5-dimethylphenoxy)propylsulfanyl]-3-fluoranyl-aniline Openeye Name: 4-[3-(2,5-dimethylphenoxy)propylsulfanyl]-3-fluoro-aniline CAS Name: 4-[3-(2,5-dimethylphenoxy)propylthio]-3-fluoroaniline IUPAC Name: 4-[3-(2,5-dimethylphenoxy)propylsulfanyl]-3-fluoroaniline Traditional Name: [4-[3-(2,5-dimethylphenoxy)propylthio]-3-fluoro-phenyl]amine Formula: C17H20FNOS MolecularWeight: 305.410203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCCCSC2=C(C=C(C=C2)N)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCCCSC2=C(C=C(C=C2)N)F

InChI

InChI=1S/C17H20FNOS/c1-12-4-5-13(2)16(10-12)20-8-3-9-21-17-7-6-14(19)11-15(17)18/h4-7,10-11H,3,8-9,19H2,1-2H3