(3-tert-butyl-4-oxidanyl-thiophen-2-yl)-[3-[[cyclohexyl(prop-2-enyl)amino]methyl]phenyl]methanone

Systemtic Name: (3-tert-butyl-4-oxidanyl-thiophen-2-yl)-[3-[[cyclohexyl(prop-2-enyl)amino]methyl]phenyl]methanone Openeye Name: [3-[[allyl(cyclohexyl)amino]methyl]phenyl]-(3-tert-butyl-4-hydroxy-2-thienyl)methanone CAS Name: (3-tert-butyl-4-hydroxy-2-thiophenyl)-[3-[[cyclohexyl(prop-2-enyl)amino]methyl]phenyl]methanone IUPAC Name: (3-tert-butyl-4-hydroxythiophen-2-yl)-[3-[[cyclohexyl(prop-2-enyl)amino]methyl]phenyl]methanone Traditional Name: [3-[[allyl(cyclohexyl)amino]methyl]phenyl]-(3-tert-butyl-4-hydroxy-2-thienyl)methanone Formula: C25H33NO2S MolecularWeight: 411.60002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(SC=C1O)C(=O)C2=CC(=CC=C2)CN(CC=C)C3CCCCC3

Isomeric SMILES

CC(C)(C)C1=C(SC=C1O)C(=O)C2=CC(=CC=C2)CN(CC=C)C3CCCCC3

InChI

InChI=1S/C25H33NO2S/c1-5-14-26(20-12-7-6-8-13-20)16-18-10-9-11-19(15-18)23(28)24-22(25(2,3)4)21(27)17-29-24/h5,9-11,15,17,20,27H,1,6-8,12-14,16H2,2-4H3