N-[[2,6-bis(fluoranyl)phenyl]methyl]-3-(3-thieno[2,3-d][1,2]oxazol-3-ylphenoxy)propan-1-amine

Systemtic Name: N-[[2,6-bis(fluoranyl)phenyl]methyl]-3-(3-thieno[2,3-d][1,2]oxazol-3-ylphenoxy)propan-1-amine Openeye Name: N-[(2,6-difluorophenyl)methyl]-3-(3-thieno[2,3-d]isoxazol-3-ylphenoxy)propan-1-amine CAS Name: N-[(2,6-difluorophenyl)methyl]-3-[3-(3-thieno[2,3-d]isoxazolyl)phenoxy]-1-propanamine IUPAC Name: N-[(2,6-difluorophenyl)methyl]-3-(3-thieno[2,3-d][1,2]oxazol-3-ylphenoxy)propan-1-amine Traditional Name: (2,6-difluorobenzyl)-[3-(3-thien[2,3-d]isoxazol-3-ylphenoxy)propyl]amine Formula: C21H18F2N2O2S MolecularWeight: 400.441626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCCNCC2=C(C=CC=C2F)F)C3=NOC4=C3SC=C4

Isomeric SMILES

C1=CC(=CC(=C1)OCCCNCC2=C(C=CC=C2F)F)C3=NOC4=C3SC=C4

InChI

InChI=1S/C21H18F2N2O2S/c22-17-6-2-7-18(23)16(17)13-24-9-3-10-26-15-5-1-4-14(12-15)20-21-19(27-25-20)8-11-28-21/h1-2,4-8,11-12,24H,3,9-10,13H2