N-methyl-4-[[2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl]amino]benzamide

Systemtic Name: N-methyl-4-[[2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl]amino]benzamide Openeye Name: N-methyl-4-[[2-(morpholin-4-ium-4-ylmethyl)-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]amino]benzamide CAS Name: N-methyl-4-[[2-(4-morpholin-4-iumylmethyl)-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinyl]amino]benzamide IUPAC Name: N-methyl-4-[[2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl]amino]benzamide Traditional Name: N-methyl-4-[[2-(morpholin-4-ium-4-ylmethyl)-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]amino]benzamide Formula: C23H24N5O2S2+ MolecularWeight: 466.59896

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)NC2=C3C(=CSC3=NC(=N2)C[NH+]4CCOCC4)C5=CC=CS5

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)NC2=C3C(=CSC3=NC(=N2)C[NH+]4CCOCC4)C5=CC=CS5

InChI

InChI=1S/C23H23N5O2S2/c1-24-22(29)15-4-6-16(7-5-15)25-21-20-17(18-3-2-12-31-18)14-32-23(20)27-19(26-21)13-28-8-10-30-11-9-28/h2-7,12,14H,8-11,13H2,1H3,(H,24,29)(H,25,26,27)/p+1