5-phenyl-2-[1-(1-propylimidazol-2-yl)sulfanylethyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-phenyl-2-[1-(1-propylimidazol-2-yl)sulfanylethyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-phenyl-2-[1-(1-propylimidazol-2-yl)sulfanylethyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-phenyl-2-[1-[(1-propyl-2-imidazolyl)thio]ethyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-phenyl-2-[1-(1-propylimidazol-2-yl)sulfanylethyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-phenyl-2-[1-[(1-propylimidazol-2-yl)thio]ethyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C20H20N4OS2 MolecularWeight: 396.529

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=CN=C1SC(C)C2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

Isomeric SMILES

CCCN1C=CN=C1SC(C)C2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

InChI

InChI=1S/C20H20N4OS2/c1-3-10-24-11-9-21-20(24)27-13(2)17-22-18(25)16-15(12-26-19(16)23-17)14-7-5-4-6-8-14/h4-9,11-13H,3,10H2,1-2H3,(H,22,23,25)