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

Systemtic Name: 3-azanyl-2-[2-(3-bromanylphenoxy)ethylsulfanyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-amino-2-[2-(3-bromophenoxy)ethylsulfanyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-amino-2-[2-(3-bromophenoxy)ethylthio]-5-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-amino-2-[2-(3-bromophenoxy)ethylsulfanyl]-5-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-amino-2-[2-(3-bromophenoxy)ethylthio]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C20H16BrN3O2S2 MolecularWeight: 474.39394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCCOC4=CC(=CC=C4)Br)N

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCCOC4=CC(=CC=C4)Br)N

InChI

InChI=1S/C20H16BrN3O2S2/c21-14-7-4-8-15(11-14)26-9-10-27-20-23-18-17(19(25)24(20)22)16(12-28-18)13-5-2-1-3-6-13/h1-8,11-12H,9-10,22H2