2-[[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[5-(4-bromophenyl)-4-thieno[2,3-d]pyrimidinyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]amino]ethyl-dimethylazanium Traditional Name: 2-[[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]amino]ethyl-dimethyl-ammonium Formula: C16H18BrN4S+ MolecularWeight: 378.30992

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC1=C2C(=CSC2=NC=N1)C3=CC=C(C=C3)Br

Isomeric SMILES

C[NH+](C)CCNC1=C2C(=CSC2=NC=N1)C3=CC=C(C=C3)Br

InChI

InChI=1S/C16H17BrN4S/c1-21(2)8-7-18-15-14-13(9-22-16(14)20-10-19-15)11-3-5-12(17)6-4-11/h3-6,9-10H,7-8H2,1-2H3,(H,18,19,20)/p+1