5,6-dimethyl-2-[(2-methylsulfonylbenzimidazol-1-yl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-[(2-methylsulfonylbenzimidazol-1-yl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-[(2-methylsulfonylbenzimidazol-1-yl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[(2-methylsulfonyl-1-benzimidazolyl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-[(2-methylsulfonylbenzimidazol-1-yl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(2-mesylbenzimidazol-1-yl)methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C17H16N4O3S2 MolecularWeight: 388.46394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CN3C4=CC=CC=C4N=C3S(=O)(=O)C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CN3C4=CC=CC=C4N=C3S(=O)(=O)C)C

InChI

InChI=1S/C17H16N4O3S2/c1-9-10(2)25-16-14(9)15(22)19-13(20-16)8-21-12-7-5-4-6-11(12)18-17(21)26(3,23)24/h4-7H,8H2,1-3H3,(H,19,20,22)