5-(4-chlorophenyl)-2-(diethylaminomethyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-chlorophenyl)-2-(diethylaminomethyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-chlorophenyl)-2-(diethylaminomethyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-chlorophenyl)-2-(diethylaminomethyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-(4-chlorophenyl)-2-(diethylaminomethyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-chlorophenyl)-2-(diethylaminomethyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C17H18ClN3OS MolecularWeight: 347.86232

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=NC2=C(C(=CS2)C3=CC=C(C=C3)Cl)C(=O)N1

Isomeric SMILES

CCN(CC)CC1=NC2=C(C(=CS2)C3=CC=C(C=C3)Cl)C(=O)N1

InChI

InChI=1S/C17H18ClN3OS/c1-3-21(4-2)9-14-19-16(22)15-13(10-23-17(15)20-14)11-5-7-12(18)8-6-11/h5-8,10H,3-4,9H2,1-2H3,(H,19,20,22)