N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]thieno[2,3-d]pyrimidin-4-amine CAS Name: N-[[2-(1-piperidin-1-iumylmethyl)phenyl]methyl]-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]thieno[2,3-d]pyrimidin-4-amine Traditional Name: [2-(piperidin-1-ium-1-ylmethyl)benzyl]-thieno[2,3-d]pyrimidin-4-yl-amine Formula: C19H23N4S+ MolecularWeight: 339.47772

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=CC=C2CNC3=C4C=CSC4=NC=N3

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=CC=C2CNC3=C4C=CSC4=NC=N3

InChI

InChI=1S/C19H22N4S/c1-4-9-23(10-5-1)13-16-7-3-2-6-15(16)12-20-18-17-8-11-24-19(17)22-14-21-18/h2-3,6-8,11,14H,1,4-5,9-10,12-13H2,(H,20,21,22)/p+1