2-(3-ethyl-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2-methoxy-5-nitro-phenyl)propanamide

Systemtic Name: 2-(3-ethyl-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2-methoxy-5-nitro-phenyl)propanamide Openeye Name: 2-(3-ethyl-5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2-methoxy-5-nitro-phenyl)propanamide CAS Name: 2-[(3-ethyl-5,6-dimethyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)thio]-N-(2-methoxy-5-nitrophenyl)propanamide IUPAC Name: 2-(3-ethyl-5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2-methoxy-5-nitrophenyl)propanamide Traditional Name: 2-[(3-ethyl-4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)thio]-N-(2-methoxy-5-nitro-phenyl)propionamide Formula: C20H22N4O5S2 MolecularWeight: 462.54248

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1SC(C)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])OC)SC(=C2C)C

Isomeric SMILES

CCN1C(=O)C2=C(N=C1SC(C)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])OC)SC(=C2C)C

InChI

InChI=1S/C20H22N4O5S2/c1-6-23-19(26)16-10(2)11(3)30-18(16)22-20(23)31-12(4)17(25)21-14-9-13(24(27)28)7-8-15(14)29-5/h7-9,12H,6H2,1-5H3,(H,21,25)