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

Systemtic Name: N-(2-methyl-3-nitro-phenyl)-2-(3,5,6-trimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-methyl-3-nitro-phenyl)-2-(3,5,6-trimethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(2-methyl-3-nitrophenyl)-2-[(3,5,6-trimethyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(2-methyl-3-nitrophenyl)-2-(3,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: 2-[(4-keto-3,5,6-trimethyl-thieno[2,3-d]pyrimidin-2-yl)thio]-N-(2-methyl-3-nitro-phenyl)acetamide Formula: C18H18N4O4S2 MolecularWeight: 418.48992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)NC3=C(C(=CC=C3)[N+](=O)[O-])C)C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)NC3=C(C(=CC=C3)[N+](=O)[O-])C)C)C

InChI

InChI=1S/C18H18N4O4S2/c1-9-11(3)28-16-15(9)17(24)21(4)18(20-16)27-8-14(23)19-12-6-5-7-13(10(12)2)22(25)26/h5-7H,8H2,1-4H3,(H,19,23)