3-[[5-(4-bromophenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]propylazanium

Systemtic Name: 3-[[5-(4-bromophenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]propylazanium Openeye Name: 3-[[5-(4-bromophenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]propylammonium CAS Name: 3-[[5-(4-bromophenyl)-6-methyl-4-thieno[2,3-d]pyrimidinyl]amino]propylammonium IUPAC Name: 3-[[5-(4-bromophenyl)-6-methylthieno[2,3-d]pyrimidin-4-yl]amino]propylazanium Traditional Name: 3-[[5-(4-bromophenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]propylammonium Formula: C16H18BrN4S+ MolecularWeight: 378.30992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N=CN=C2S1)NCCC[NH3+])C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C2=C(N=CN=C2S1)NCCC[NH3+])C3=CC=C(C=C3)Br

InChI

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