5,6-dimethyl-2-[(1R)-1-(3-methyl-4-nitro-phenoxy)ethyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-[(1R)-1-(3-methyl-4-nitro-phenoxy)ethyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-[(1R)-1-(3-methyl-4-nitro-phenoxy)ethyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[(1R)-1-(3-methyl-4-nitrophenoxy)ethyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-[(1R)-1-(3-methyl-4-nitrophenoxy)ethyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-2-[(1R)-1-(3-methyl-4-nitro-phenoxy)ethyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C17H17N3O4S MolecularWeight: 359.39958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(C)C2=NC3=C(C(=C(S3)C)C)C(=O)N2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)O[C@H](C)C2=NC3=C(C(=C(S3)C)C)C(=O)N2)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O4S/c1-8-7-12(5-6-13(8)20(22)23)24-10(3)15-18-16(21)14-9(2)11(4)25-17(14)19-15/h5-7,10H,1-4H3,(H,18,19,21)/t10-/m1/s1