1-[5-(3-azanyl-3-methyl-4-oxidanyl-butyl)thiophen-2-yl]-5-(3-fluorophenyl)pentan-1-one

Systemtic Name: 1-[5-(3-azanyl-3-methyl-4-oxidanyl-butyl)thiophen-2-yl]-5-(3-fluorophenyl)pentan-1-one Openeye Name: 1-[5-(3-amino-4-hydroxy-3-methyl-butyl)-2-thienyl]-5-(3-fluorophenyl)pentan-1-one CAS Name: 1-[5-(3-amino-4-hydroxy-3-methylbutyl)-2-thiophenyl]-5-(3-fluorophenyl)-1-pentanone IUPAC Name: 1-[5-(3-amino-4-hydroxy-3-methylbutyl)thiophen-2-yl]-5-(3-fluorophenyl)pentan-1-one Traditional Name: 1-[5-(3-amino-4-hydroxy-3-methyl-butyl)-2-thienyl]-5-(3-fluorophenyl)pentan-1-one Formula: C20H26FNO2S MolecularWeight: 363.489343

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(S1)C(=O)CCCCC2=CC(=CC=C2)F)(CO)N

Isomeric SMILES

CC(CCC1=CC=C(S1)C(=O)CCCCC2=CC(=CC=C2)F)(CO)N

InChI

InChI=1S/C20H26FNO2S/c1-20(22,14-23)12-11-17-9-10-19(25-17)18(24)8-3-2-5-15-6-4-7-16(21)13-15/h4,6-7,9-10,13,23H,2-3,5,8,11-12,14,22H2,1H3