5,6-dimethyl-4-(4-methyl-1,4-diazepan-4-ium-1-yl)thieno[2,3-d]pyrimidine

Systemtic Name: 5,6-dimethyl-4-(4-methyl-1,4-diazepan-4-ium-1-yl)thieno[2,3-d]pyrimidine Openeye Name: 5,6-dimethyl-4-(4-methyl-1,4-diazepan-4-ium-1-yl)thieno[2,3-d]pyrimidine CAS Name: 5,6-dimethyl-4-(4-methyl-1,4-diazepan-4-ium-1-yl)thieno[2,3-d]pyrimidine IUPAC Name: 5,6-dimethyl-4-(4-methyl-1,4-diazepan-4-ium-1-yl)thieno[2,3-d]pyrimidine Traditional Name: 5,6-dimethyl-4-(4-methyl-1,4-diazepan-4-ium-1-yl)thieno[2,3-d]pyrimidine Formula: C14H21N4S+ MolecularWeight: 277.40834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N3CCC[NH+](CC3)C)C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CCC[NH+](CC3)C)C

InChI

InChI=1S/C14H20N4S/c1-10-11(2)19-14-12(10)13(15-9-16-14)18-6-4-5-17(3)7-8-18/h9H,4-8H2,1-3H3/p+1