2-[(3-fluorophenyl)methylsulfanyl]-3-(3-methylbutyl)thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[(3-fluorophenyl)methylsulfanyl]-3-(3-methylbutyl)thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[(3-fluorophenyl)methylsulfanyl]-3-isopentyl-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[(3-fluorophenyl)methylthio]-3-(3-methylbutyl)-4-thieno[3,2-d]pyrimidinone IUPAC Name: 2-[(3-fluorophenyl)methylsulfanyl]-3-(3-methylbutyl)thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[(3-fluorobenzyl)thio]-3-isoamyl-thieno[3,2-d]pyrimidin-4-one Formula: C18H19FN2OS2 MolecularWeight: 362.484663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=C(C=CS2)N=C1SCC3=CC(=CC=C3)F

Isomeric SMILES

CC(C)CCN1C(=O)C2=C(C=CS2)N=C1SCC3=CC(=CC=C3)F

InChI

InChI=1S/C18H19FN2OS2/c1-12(2)6-8-21-17(22)16-15(7-9-23-16)20-18(21)24-11-13-4-3-5-14(19)10-13/h3-5,7,9-10,12H,6,8,11H2,1-2H3