5-[bis(fluoranyl)methyl]-1-butyl-2-sulfanylidene-7-thiophen-2-yl-pyrido[2,3-d]pyrimidin-4-one

Systemtic Name: 5-[bis(fluoranyl)methyl]-1-butyl-2-sulfanylidene-7-thiophen-2-yl-pyrido[2,3-d]pyrimidin-4-one Openeye Name: 1-butyl-5-(difluoromethyl)-7-(2-thienyl)-2-thioxo-pyrido[2,3-d]pyrimidin-4-one CAS Name: 1-butyl-5-(difluoromethyl)-2-sulfanylidene-7-thiophen-2-yl-4-pyrido[2,3-d]pyrimidinone IUPAC Name: 1-butyl-5-(difluoromethyl)-2-sulfanylidene-7-thiophen-2-ylpyrido[2,3-d]pyrimidin-4-one Traditional Name: 1-butyl-5-(difluoromethyl)-7-(2-thienyl)-2-thioxo-pyrido[2,3-d]pyrimidin-4-one Formula: C16H15F2N3OS2 MolecularWeight: 367.436606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=CC(=N2)C3=CC=CS3)C(F)F)C(=O)NC1=S

Isomeric SMILES

CCCCN1C2=C(C(=CC(=N2)C3=CC=CS3)C(F)F)C(=O)NC1=S

InChI

InChI=1S/C16H15F2N3OS2/c1-2-3-6-21-14-12(15(22)20-16(21)23)9(13(17)18)8-10(19-14)11-5-4-7-24-11/h4-5,7-8,13H,2-3,6H2,1H3,(H,20,22,23)