5-phenyl-2-(quinazolin-4-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-phenyl-2-(quinazolin-4-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-phenyl-2-(quinazolin-4-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-phenyl-2-[(4-quinazolinylthio)methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-phenyl-2-(quinazolin-4-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-phenyl-2-[(quinazolin-4-ylthio)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H14N4OS2 MolecularWeight: 402.49206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)CSC4=NC=NC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)CSC4=NC=NC5=CC=CC=C54

InChI

InChI=1S/C21H14N4OS2/c26-19-18-15(13-6-2-1-3-7-13)10-27-21(18)25-17(24-19)11-28-20-14-8-4-5-9-16(14)22-12-23-20/h1-10,12H,11H2,(H,24,25,26)