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

Systemtic Name: N-[(3-fluoranyl-2-methyl-phenyl)methyl]phenoxathiin-3-amine Openeye Name: N-[(3-fluoro-2-methyl-phenyl)methyl]phenoxathiin-3-amine CAS Name: N-[(3-fluoro-2-methylphenyl)methyl]-3-phenoxathiinamine IUPAC Name: N-[(3-fluoro-2-methylphenyl)methyl]phenoxathiin-3-amine Traditional Name: (3-fluoro-2-methyl-benzyl)-phenoxathiin-3-yl-amine Formula: C20H16FNOS MolecularWeight: 337.410543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1F)CNC2=CC3=C(C=C2)SC4=CC=CC=C4O3

Isomeric SMILES

CC1=C(C=CC=C1F)CNC2=CC3=C(C=C2)SC4=CC=CC=C4O3

InChI

InChI=1S/C20H16FNOS/c1-13-14(5-4-6-16(13)21)12-22-15-9-10-20-18(11-15)23-17-7-2-3-8-19(17)24-20/h2-11,22H,12H2,1H3