3-azanyl-5-(1-propylsulfanylethyl)-2-[3-(trifluoromethyl)phenyl]cyclopent-2-en-1-one

Systemtic Name: 3-azanyl-5-(1-propylsulfanylethyl)-2-[3-(trifluoromethyl)phenyl]cyclopent-2-en-1-one Openeye Name: 3-amino-5-(1-propylsulfanylethyl)-2-[3-(trifluoromethyl)phenyl]cyclopent-2-en-1-one CAS Name: 3-amino-5-[1-(propylthio)ethyl]-2-[3-(trifluoromethyl)phenyl]-1-cyclopent-2-enone IUPAC Name: 3-amino-5-(1-propylsulfanylethyl)-2-[3-(trifluoromethyl)phenyl]cyclopent-2-en-1-one Traditional Name: 3-amino-5-[1-(propylthio)ethyl]-2-[3-(trifluoromethyl)phenyl]cyclopent-2-en-1-one Formula: C17H20F3NOS MolecularWeight: 343.40701

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC(C)C1CC(=C(C1=O)C2=CC(=CC=C2)C(F)(F)F)N

Isomeric SMILES

CCCSC(C)C1CC(=C(C1=O)C2=CC(=CC=C2)C(F)(F)F)N

InChI

InChI=1S/C17H20F3NOS/c1-3-7-23-10(2)13-9-14(21)15(16(13)22)11-5-4-6-12(8-11)17(18,19)20/h4-6,8,10,13H,3,7,9,21H2,1-2H3