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

Systemtic Name: 5-(4-chlorophenyl)-2-[(4-methylphenyl)sulfonylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-chlorophenyl)-2-(p-tolylsulfonylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-chlorophenyl)-2-[(4-methylphenyl)sulfonylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-(4-chlorophenyl)-2-[(4-methylphenyl)sulfonylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-chlorophenyl)-2-(tosylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C20H15ClN2O3S2 MolecularWeight: 430.9277

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2=NC3=C(C(=CS3)C4=CC=C(C=C4)Cl)C(=O)N2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2=NC3=C(C(=CS3)C4=CC=C(C=C4)Cl)C(=O)N2

InChI

InChI=1S/C20H15ClN2O3S2/c1-12-2-8-15(9-3-12)28(25,26)11-17-22-19(24)18-16(10-27-20(18)23-17)13-4-6-14(21)7-5-13/h2-10H,11H2,1H3,(H,22,23,24)