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

Systemtic Name: [3-tert-butyl-5-[(dicyclohexylamino)methyl]-4-oxidanyl-phenyl]-thiophen-2-yl-methanone Openeye Name: [3-tert-butyl-5-[(dicyclohexylamino)methyl]-4-hydroxy-phenyl]-(2-thienyl)methanone CAS Name: [3-tert-butyl-5-[(dicyclohexylamino)methyl]-4-hydroxyphenyl]-thiophen-2-ylmethanone IUPAC Name: [3-tert-butyl-5-[(dicyclohexylamino)methyl]-4-hydroxyphenyl]-thiophen-2-ylmethanone Traditional Name: [3-tert-butyl-5-[(dicyclohexylamino)methyl]-4-hydroxy-phenyl]-(2-thienyl)methanone Formula: C28H39NO2S MolecularWeight: 453.67976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)CN(C2CCCCC2)C3CCCCC3)C(=O)C4=CC=CS4

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)CN(C2CCCCC2)C3CCCCC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C28H39NO2S/c1-28(2,3)24-18-20(27(31)25-15-10-16-32-25)17-21(26(24)30)19-29(22-11-6-4-7-12-22)23-13-8-5-9-14-23/h10,15-18,22-23,30H,4-9,11-14,19H2,1-3H3