2-(1-chloroethyl)-5-(2,5-dimethylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-(1-chloroethyl)-5-(2,5-dimethylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(1-chloroethyl)-5-(2,5-dimethylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-(1-chloroethyl)-5-(2,5-dimethylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-(1-chloroethyl)-5-(2,5-dimethylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(1-chloroethyl)-5-(2,5-dimethylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C16H15ClN2OS MolecularWeight: 318.8211

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=CSC3=C2C(=O)NC(=N3)C(C)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=CSC3=C2C(=O)NC(=N3)C(C)Cl

InChI

InChI=1S/C16H15ClN2OS/c1-8-4-5-9(2)11(6-8)12-7-21-16-13(12)15(20)18-14(19-16)10(3)17/h4-7,10H,1-3H3,(H,18,19,20)