3-hexyl-6-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-hexyl-6-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-hexyl-6-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-hexyl-6-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-hexyl-6-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-hexyl-6-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C18H20N2OS MolecularWeight: 312.4292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C=NC2=C(C1=O)C=C(S2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCN1C=NC2=C(C1=O)C=C(S2)C3=CC=CC=C3

InChI

InChI=1S/C18H20N2OS/c1-2-3-4-8-11-20-13-19-17-15(18(20)21)12-16(22-17)14-9-6-5-7-10-14/h5-7,9-10,12-13H,2-4,8,11H2,1H3