4-chloranyl-N-(4,6-dimethyl-2-morpholin-4-ylcarbonyl-thieno[2,3-b]pyridin-3-yl)-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-(4,6-dimethyl-2-morpholin-4-ylcarbonyl-thieno[2,3-b]pyridin-3-yl)-3-nitro-benzamide Openeye Name: 4-chloro-N-[4,6-dimethyl-2-(morpholine-4-carbonyl)thieno[2,3-b]pyridin-3-yl]-3-nitro-benzamide CAS Name: 4-chloro-N-[4,6-dimethyl-2-[4-morpholinyl(oxo)methyl]-3-thieno[2,3-b]pyridinyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[4,6-dimethyl-2-(morpholine-4-carbonyl)thieno[2,3-b]pyridin-3-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[4,6-dimethyl-2-(morpholine-4-carbonyl)thieno[2,3-b]pyridin-3-yl]-3-nitro-benzamide Formula: C21H19ClN4O5S MolecularWeight: 474.91736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=C(S2)C(=O)N3CCOCC3)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NC2=C1C(=C(S2)C(=O)N3CCOCC3)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C21H19ClN4O5S/c1-11-9-12(2)23-20-16(11)17(18(32-20)21(28)25-5-7-31-8-6-25)24-19(27)13-3-4-14(22)15(10-13)26(29)30/h3-4,9-10H,5-8H2,1-2H3,(H,24,27)