N-[[2,3,6-tris(fluoranyl)phenyl]methyl]phenoxathiin-3-amine

Systemtic Name: N-[[2,3,6-tris(fluoranyl)phenyl]methyl]phenoxathiin-3-amine Openeye Name: N-[(2,3,6-trifluorophenyl)methyl]phenoxathiin-3-amine CAS Name: N-[(2,3,6-trifluorophenyl)methyl]-3-phenoxathiinamine IUPAC Name: N-[(2,3,6-trifluorophenyl)methyl]phenoxathiin-3-amine Traditional Name: phenoxathiin-3-yl-(2,3,6-trifluorobenzyl)amine Formula: C19H12F3NOS MolecularWeight: 359.36489

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)OC3=C(S2)C=CC(=C3)NCC4=C(C=CC(=C4F)F)F

Isomeric SMILES

C1=CC=C2C(=C1)OC3=C(S2)C=CC(=C3)NCC4=C(C=CC(=C4F)F)F

InChI

InChI=1S/C19H12F3NOS/c20-13-6-7-14(21)19(22)12(13)10-23-11-5-8-18-16(9-11)24-15-3-1-2-4-17(15)25-18/h1-9,23H,10H2