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

Systemtic Name: 2-[(3-chlorophenyl)methyl]-5-(4-propan-2-ylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(3-chlorophenyl)methyl]-5-(4-isopropylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(3-chlorophenyl)methyl]-5-(4-propan-2-ylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(3-chlorophenyl)methyl]-5-(4-propan-2-ylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(3-chlorobenzyl)-5-p-cumenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C22H19ClN2OS MolecularWeight: 394.91706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)CC4=CC(=CC=C4)Cl

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H19ClN2OS/c1-13(2)15-6-8-16(9-7-15)18-12-27-22-20(18)21(26)24-19(25-22)11-14-4-3-5-17(23)10-14/h3-10,12-13H,11H2,1-2H3,(H,24,25,26)