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

Systemtic Name: N-(4-chloranyl-2-nitro-phenyl)-2-(3-ethyl-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-chloro-2-nitro-phenyl)-2-(3-ethyl-5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(4-chloro-2-nitrophenyl)-2-[(3-ethyl-5,6-dimethyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(4-chloro-2-nitrophenyl)-2-(3-ethyl-5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(4-chloro-2-nitro-phenyl)-2-[(3-ethyl-4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)thio]acetamide Formula: C18H17ClN4O4S2 MolecularWeight: 452.93498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1SCC(=O)NC3=C(C=C(C=C3)Cl)[N+](=O)[O-])SC(=C2C)C

Isomeric SMILES

CCN1C(=O)C2=C(N=C1SCC(=O)NC3=C(C=C(C=C3)Cl)[N+](=O)[O-])SC(=C2C)C

InChI

InChI=1S/C18H17ClN4O4S2/c1-4-22-17(25)15-9(2)10(3)29-16(15)21-18(22)28-8-14(24)20-12-6-5-11(19)7-13(12)23(26)27/h5-7H,4,8H2,1-3H3,(H,20,24)