3-azanyl-2-[2-(4-ethoxyphenoxy)ethylsulfanyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-azanyl-2-[2-(4-ethoxyphenoxy)ethylsulfanyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-amino-2-[2-(4-ethoxyphenoxy)ethylsulfanyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-amino-2-[2-(4-ethoxyphenoxy)ethylthio]-5-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-amino-2-[2-(4-ethoxyphenoxy)ethylsulfanyl]-5-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-amino-2-[2-(4-ethoxyphenoxy)ethylthio]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C22H21N3O3S2 MolecularWeight: 439.55044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCSC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2N

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCSC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2N

InChI

InChI=1S/C22H21N3O3S2/c1-2-27-16-8-10-17(11-9-16)28-12-13-29-22-24-20-19(21(26)25(22)23)18(14-30-20)15-6-4-3-5-7-15/h3-11,14H,2,12-13,23H2,1H3