N-(2-methyl-5-methylsulfonyl-phenyl)-3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanamide

Systemtic Name: N-(2-methyl-5-methylsulfonyl-phenyl)-3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanamide Openeye Name: N-(2-methyl-5-methylsulfonyl-phenyl)-3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide CAS Name: N-(2-methyl-5-methylsulfonylphenyl)-3-(4-oxo-3-thieno[2,3-d]pyrimidinyl)propanamide IUPAC Name: N-(2-methyl-5-methylsulfonylphenyl)-3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide Traditional Name: 3-(4-ketothieno[2,3-d]pyrimidin-3-yl)-N-(5-mesyl-2-methyl-phenyl)propionamide Formula: C17H17N3O4S2 MolecularWeight: 391.46458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)NC(=O)CCN2C=NC3=C(C2=O)C=CS3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)NC(=O)CCN2C=NC3=C(C2=O)C=CS3

InChI

InChI=1S/C17H17N3O4S2/c1-11-3-4-12(26(2,23)24)9-14(11)19-15(21)5-7-20-10-18-16-13(17(20)22)6-8-25-16/h3-4,6,8-10H,5,7H2,1-2H3,(H,19,21)