5-phenyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 5-phenyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-5-phenyl-thieno[2,3-d]pyrimidin-4-amine CAS Name: 5-phenyl-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-(5-phenylthieno[2,3-d]pyrimidin-4-yl)amine Formula: C24H25N4S+ MolecularWeight: 401.5471

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC2=C3C(=CSC3=NC=N2)C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1C[NH+](CCC1NC2=C3C(=CSC3=NC=N2)C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C24H24N4S/c1-3-7-18(8-4-1)15-28-13-11-20(12-14-28)27-23-22-21(19-9-5-2-6-10-19)16-29-24(22)26-17-25-23/h1-10,16-17,20H,11-15H2,(H,25,26,27)/p+1