methyl-[2-[(4-morpholin-4-ylphenyl)amino]-2-oxidanylidene-ethyl]-[(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]azanium

Systemtic Name: methyl-[2-[(4-morpholin-4-ylphenyl)amino]-2-oxidanylidene-ethyl]-[(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]azanium Openeye Name: methyl-[2-(4-morpholinoanilino)-2-oxo-ethyl]-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]ammonium CAS Name: methyl-[2-[4-(4-morpholinyl)anilino]-2-oxoethyl]-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]ammonium IUPAC Name: methyl-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]azanium Traditional Name: [2-keto-2-(4-morpholinoanilino)ethyl]-[(4-keto-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]-methyl-ammonium Formula: C26H28N5O3S+ MolecularWeight: 490.59722

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1)CC(=O)NC4=CC=C(C=C4)N5CCOCC5

Isomeric SMILES

C[NH+](CC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1)CC(=O)NC4=CC=C(C=C4)N5CCOCC5

InChI

InChI=1S/C26H27N5O3S/c1-30(16-23(32)27-19-7-9-20(10-8-19)31-11-13-34-14-12-31)15-22-28-25(33)24-21(17-35-26(24)29-22)18-5-3-2-4-6-18/h2-10,17H,11-16H2,1H3,(H,27,32)(H,28,29,33)/p+1