3-[(3-azanyl-4-chloranyl-phenyl)methyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[(3-azanyl-4-chloranyl-phenyl)methyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(3-amino-4-chloro-phenyl)methyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(3-amino-4-chlorophenyl)methyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[(3-amino-4-chlorophenyl)methyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(3-amino-4-chloro-benzyl)thieno[2,3-d]pyrimidin-4-one Formula: C13H10ClN3OS MolecularWeight: 291.756

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CN2C=NC3=C(C2=O)C=CS3)N)Cl

Isomeric SMILES

C1=CC(=C(C=C1CN2C=NC3=C(C2=O)C=CS3)N)Cl

InChI

InChI=1S/C13H10ClN3OS/c14-10-2-1-8(5-11(10)15)6-17-7-16-12-9(13(17)18)3-4-19-12/h1-5,7H,6,15H2