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

Systemtic Name: 3-azanyl-2-[2-(4-methylphenoxy)ethylsulfanyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-amino-2-[2-(4-methylphenoxy)ethylsulfanyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-amino-2-[2-(4-methylphenoxy)ethylthio]-5-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-amino-2-[2-(4-methylphenoxy)ethylsulfanyl]-5-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-amino-2-[2-(4-methylphenoxy)ethylthio]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H19N3O2S2 MolecularWeight: 409.52446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCSC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2N

Isomeric SMILES

CC1=CC=C(C=C1)OCCSC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2N

InChI

InChI=1S/C21H19N3O2S2/c1-14-7-9-16(10-8-14)26-11-12-27-21-23-19-18(20(25)24(21)22)17(13-28-19)15-5-3-2-4-6-15/h2-10,13H,11-12,22H2,1H3