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

Systemtic Name: N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-methyl-N-[(5-methyl-2-furyl)methyl]-2-(morpholin-4-ium-4-ylmethyl)-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: N-methyl-N-[(5-methyl-2-furanyl)methyl]-2-(4-morpholin-4-iumylmethyl)-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: methyl-[(5-methyl-2-furyl)methyl]-[2-(morpholin-4-ium-4-ylmethyl)-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]amine Formula: C22H25N4O2S2+ MolecularWeight: 441.5895

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN(C)C2=C3C(=CSC3=NC(=N2)C[NH+]4CCOCC4)C5=CC=CS5

Isomeric SMILES

CC1=CC=C(O1)CN(C)C2=C3C(=CSC3=NC(=N2)C[NH+]4CCOCC4)C5=CC=CS5

InChI

InChI=1S/C22H24N4O2S2/c1-15-5-6-16(28-15)12-25(2)21-20-17(18-4-3-11-29-18)14-30-22(20)24-19(23-21)13-26-7-9-27-10-8-26/h3-6,11,14H,7-10,12-13H2,1-2H3/p+1