N-[3-dimethoxyphosphoryl-1-[[3-methyl-4-(3-oxidanylidenemorpholin-4-yl)phenyl]amino]-1-oxidanylidene-propan-2-yl]-5-ethynyl-thiophene-2-carboxamide

Systemtic Name: N-[3-dimethoxyphosphoryl-1-[[3-methyl-4-(3-oxidanylidenemorpholin-4-yl)phenyl]amino]-1-oxidanylidene-propan-2-yl]-5-ethynyl-thiophene-2-carboxamide Openeye Name: N-[1-(dimethoxyphosphorylmethyl)-2-[3-methyl-4-(3-oxomorpholin-4-yl)anilino]-2-oxo-ethyl]-5-ethynyl-thiophene-2-carboxamide CAS Name: N-[3-dimethoxyphosphoryl-1-[3-methyl-4-(3-oxo-4-morpholinyl)anilino]-1-oxopropan-2-yl]-5-ethynyl-2-thiophenecarboxamide IUPAC Name: N-[3-dimethoxyphosphoryl-1-[3-methyl-4-(3-oxomorpholin-4-yl)anilino]-1-oxopropan-2-yl]-5-ethynylthiophene-2-carboxamide Traditional Name: N-[1-(dimethoxyphosphorylmethyl)-2-keto-2-[4-(3-ketomorpholino)-3-methyl-anilino]ethyl]-5-ethynyl-thiophene-2-carboxamide Formula: C23H26N3O7PS MolecularWeight: 519.507201

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C(CP(=O)(OC)OC)NC(=O)C2=CC=C(S2)C#C)N3CCOCC3=O

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C(CP(=O)(OC)OC)NC(=O)C2=CC=C(S2)C#C)N3CCOCC3=O

InChI

InChI=1S/C23H26N3O7PS/c1-5-17-7-9-20(35-17)23(29)25-18(14-34(30,31-3)32-4)22(28)24-16-6-8-19(15(2)12-16)26-10-11-33-13-21(26)27/h1,6-9,12,18H,10-11,13-14H2,2-4H3,(H,24,28)(H,25,29)