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

Systemtic Name: 2-(3-ethyl-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(3-nitrophenyl)propanamide Openeye Name: 2-(3-ethyl-5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(3-nitrophenyl)propanamide CAS Name: 2-[(3-ethyl-5,6-dimethyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)thio]-N-(3-nitrophenyl)propanamide IUPAC Name: 2-(3-ethyl-5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(3-nitrophenyl)propanamide Traditional Name: 2-[(3-ethyl-4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)thio]-N-(3-nitrophenyl)propionamide Formula: C19H20N4O4S2 MolecularWeight: 432.5165

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N4O4S2/c1-5-22-18(25)15-10(2)11(3)28-17(15)21-19(22)29-12(4)16(24)20-13-7-6-8-14(9-13)23(26)27/h6-9,12H,5H2,1-4H3,(H,20,24)