N-[[3-chloranyl-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-2-phenyl-1,3-benzoxazol-5-amine

Systemtic Name: N-[[3-chloranyl-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-2-phenyl-1,3-benzoxazol-5-amine Openeye Name: N-[[3-chloro-5-methoxy-4-(2-thienylmethoxy)phenyl]methyl]-2-phenyl-1,3-benzoxazol-5-amine CAS Name: N-[[3-chloro-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-2-phenyl-1,3-benzoxazol-5-amine IUPAC Name: N-[[3-chloro-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-2-phenyl-1,3-benzoxazol-5-amine Traditional Name: [3-chloro-5-methoxy-4-(2-thenyloxy)benzyl]-(2-phenyl-1,3-benzoxazol-5-yl)amine Formula: C26H21ClN2O3S MolecularWeight: 476.97454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNC2=CC3=C(C=C2)OC(=N3)C4=CC=CC=C4)Cl)OCC5=CC=CS5

Isomeric SMILES

COC1=C(C(=CC(=C1)CNC2=CC3=C(C=C2)OC(=N3)C4=CC=CC=C4)Cl)OCC5=CC=CS5

InChI

InChI=1S/C26H21ClN2O3S/c1-30-24-13-17(12-21(27)25(24)31-16-20-8-5-11-33-20)15-28-19-9-10-23-22(14-19)29-26(32-23)18-6-3-2-4-7-18/h2-14,28H,15-16H2,1H3