[3-tert-butyl-5-[(dihexylamino)methyl]-4-oxidanyl-phenyl]-thiophen-2-yl-methanone

Systemtic Name: [3-tert-butyl-5-[(dihexylamino)methyl]-4-oxidanyl-phenyl]-thiophen-2-yl-methanone Openeye Name: [3-tert-butyl-5-[(dihexylamino)methyl]-4-hydroxy-phenyl]-(2-thienyl)methanone CAS Name: [3-tert-butyl-5-[(dihexylamino)methyl]-4-hydroxyphenyl]-thiophen-2-ylmethanone IUPAC Name: [3-tert-butyl-5-[(dihexylamino)methyl]-4-hydroxyphenyl]-thiophen-2-ylmethanone Traditional Name: [3-tert-butyl-5-[(dihexylamino)methyl]-4-hydroxy-phenyl]-(2-thienyl)methanone Formula: C28H43NO2S MolecularWeight: 457.71152

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCCCCC)CC1=C(C(=CC(=C1)C(=O)C2=CC=CS2)C(C)(C)C)O

Isomeric SMILES

CCCCCCN(CCCCCC)CC1=C(C(=CC(=C1)C(=O)C2=CC=CS2)C(C)(C)C)O

InChI

InChI=1S/C28H43NO2S/c1-6-8-10-12-16-29(17-13-11-9-7-2)21-23-19-22(27(31)25-15-14-18-32-25)20-24(26(23)30)28(3,4)5/h14-15,18-20,30H,6-13,16-17,21H2,1-5H3