N-[3-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propyl]thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-[3-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propyl]thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-[3-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propyl]thieno[2,3-d]pyrimidin-4-amine CAS Name: N-[3-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]propyl]-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-[3-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propyl]thieno[2,3-d]pyrimidin-4-amine Traditional Name: 3-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]propyl-thieno[2,3-d]pyrimidin-4-yl-amine Formula: C17H22N7S+ MolecularWeight: 356.46848

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCNC2=C3C=CSC3=NC=N2)C4=NC=CC=N4

Isomeric SMILES

C1CN(CC[NH+]1CCCNC2=C3C=CSC3=NC=N2)C4=NC=CC=N4

InChI

InChI=1S/C17H21N7S/c1-4-19-17(20-5-1)24-10-8-23(9-11-24)7-2-6-18-15-14-3-12-25-16(14)22-13-21-15/h1,3-5,12-13H,2,6-11H2,(H,18,21,22)/p+1