3-(1,3-benzoxazol-2-yl)-N-[[2-(thiophen-2-ylmethoxy)phenyl]methyl]aniline

Systemtic Name: 3-(1,3-benzoxazol-2-yl)-N-[[2-(thiophen-2-ylmethoxy)phenyl]methyl]aniline Openeye Name: 3-(1,3-benzoxazol-2-yl)-N-[[2-(2-thienylmethoxy)phenyl]methyl]aniline CAS Name: 3-(1,3-benzoxazol-2-yl)-N-[[2-(thiophen-2-ylmethoxy)phenyl]methyl]aniline IUPAC Name: 3-(1,3-benzoxazol-2-yl)-N-[[2-(thiophen-2-ylmethoxy)phenyl]methyl]aniline Traditional Name: [3-(1,3-benzoxazol-2-yl)phenyl]-[2-(2-thenyloxy)benzyl]amine Formula: C25H20N2O2S MolecularWeight: 412.5035

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC2=CC=CC(=C2)C3=NC4=CC=CC=C4O3)OCC5=CC=CS5

Isomeric SMILES

C1=CC=C(C(=C1)CNC2=CC=CC(=C2)C3=NC4=CC=CC=C4O3)OCC5=CC=CS5

InChI

InChI=1S/C25H20N2O2S/c1-3-12-23(28-17-21-10-6-14-30-21)19(7-1)16-26-20-9-5-8-18(15-20)25-27-22-11-2-4-13-24(22)29-25/h1-15,26H,16-17H2