5,6-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-2-(pyrrolidin-1-ium-1-ylmethyl)thieno[2,3-d]pyrimidine

Systemtic Name: 5,6-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-2-(pyrrolidin-1-ium-1-ylmethyl)thieno[2,3-d]pyrimidine Openeye Name: 5,6-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-2-(pyrrolidin-1-ium-1-ylmethyl)thieno[2,3-d]pyrimidine CAS Name: 5,6-dimethyl-4-(4-methyl-1-piperazin-4-iumyl)-2-(1-pyrrolidin-1-iumylmethyl)thieno[2,3-d]pyrimidine IUPAC Name: 5,6-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-2-(pyrrolidin-1-ium-1-ylmethyl)thieno[2,3-d]pyrimidine Traditional Name: 5,6-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-2-(pyrrolidin-1-ium-1-ylmethyl)thieno[2,3-d]pyrimidine Formula: C18H29N5S+2 MolecularWeight: 347.52136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N3CC[NH+](CC3)C)C[NH+]4CCCC4)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N3CC[NH+](CC3)C)C[NH+]4CCCC4)C

InChI

InChI=1S/C18H27N5S/c1-13-14(2)24-18-16(13)17(23-10-8-21(3)9-11-23)19-15(20-18)12-22-6-4-5-7-22/h4-12H2,1-3H3/p+2