N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]thieno[2,3-d]pyrimidin-4-amine CAS Name: N-[(2R)-2-phenyl-2-(1-pyrrolidin-1-iumyl)ethyl]-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-ylethyl]thieno[2,3-d]pyrimidin-4-amine Traditional Name: [(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]-thieno[2,3-d]pyrimidin-4-yl-amine Formula: C18H21N4S+ MolecularWeight: 325.45114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC2=C3C=CSC3=NC=N2)C4=CC=CC=C4

Isomeric SMILES

C1CC[NH+](C1)[C@@H](CNC2=C3C=CSC3=NC=N2)C4=CC=CC=C4

InChI

InChI=1S/C18H20N4S/c1-2-6-14(7-3-1)16(22-9-4-5-10-22)12-19-17-15-8-11-23-18(15)21-13-20-17/h1-3,6-8,11,13,16H,4-5,9-10,12H2,(H,19,20,21)/p+1/t16-/m0/s1