[2-(2-azanyl-2-ethyl-hexyl)sulfanylphenyl]-(4-phenylmethoxyphenyl)methanone

Systemtic Name: [2-(2-azanyl-2-ethyl-hexyl)sulfanylphenyl]-(4-phenylmethoxyphenyl)methanone Openeye Name: [2-(2-amino-2-ethyl-hexyl)sulfanylphenyl]-(4-benzyloxyphenyl)methanone CAS Name: [2-[(2-amino-2-ethylhexyl)thio]phenyl]-(4-phenylmethoxyphenyl)methanone IUPAC Name: [2-(2-amino-2-ethylhexyl)sulfanylphenyl]-(4-phenylmethoxyphenyl)methanone Traditional Name: [2-[(2-amino-2-ethyl-hexyl)thio]phenyl]-(4-benzoxyphenyl)methanone Formula: C28H33NO2S MolecularWeight: 447.63212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)(CSC1=CC=CC=C1C(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)N

Isomeric SMILES

CCCCC(CC)(CSC1=CC=CC=C1C(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)N

InChI

InChI=1S/C28H33NO2S/c1-3-5-19-28(29,4-2)21-32-26-14-10-9-13-25(26)27(30)23-15-17-24(18-16-23)31-20-22-11-7-6-8-12-22/h6-18H,3-5,19-21,29H2,1-2H3