4-[(4-pyrrolidin-1-yl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl)methyl]morpholin-4-ium

Systemtic Name: 4-[(4-pyrrolidin-1-yl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl)methyl]morpholin-4-ium Openeye Name: 4-[[4-pyrrolidin-1-yl-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]methyl]morpholin-4-ium CAS Name: 4-[[4-(1-pyrrolidinyl)-5-thiophen-2-yl-2-thieno[2,3-d]pyrimidinyl]methyl]morpholin-4-ium IUPAC Name: 4-[(4-pyrrolidin-1-yl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-2-yl)methyl]morpholin-4-ium Traditional Name: 4-[[4-pyrrolidino-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]methyl]morpholin-4-ium Formula: C19H23N4OS2+ MolecularWeight: 387.54212

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C3C(=CSC3=NC(=N2)C[NH+]4CCOCC4)C5=CC=CS5

Isomeric SMILES

C1CCN(C1)C2=C3C(=CSC3=NC(=N2)C[NH+]4CCOCC4)C5=CC=CS5

InChI

InChI=1S/C19H22N4OS2/c1-2-6-23(5-1)18-17-14(15-4-3-11-25-15)13-26-19(17)21-16(20-18)12-22-7-9-24-10-8-22/h3-4,11,13H,1-2,5-10,12H2/p+1