3-azanyl-2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-azanyl-2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(5-acetyl-2-methoxy-phenyl)methylsulfanyl]-3-amino-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(5-acetyl-2-methoxyphenyl)methylthio]-3-amino-5-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]-3-amino-5-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(5-acetyl-2-methoxy-benzyl)thio]-3-amino-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C22H19N3O3S2 MolecularWeight: 437.53456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2N

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2N

InChI

InChI=1S/C22H19N3O3S2/c1-13(26)15-8-9-18(28-2)16(10-15)11-30-22-24-20-19(21(27)25(22)23)17(12-29-20)14-6-4-3-5-7-14/h3-10,12H,11,23H2,1-2H3