2-methyl-4-(4-methylpiperazin-4-ium-1-yl)-5-phenyl-thieno[2,3-d]pyrimidine

Systemtic Name: 2-methyl-4-(4-methylpiperazin-4-ium-1-yl)-5-phenyl-thieno[2,3-d]pyrimidine Openeye Name: 2-methyl-4-(4-methylpiperazin-4-ium-1-yl)-5-phenyl-thieno[2,3-d]pyrimidine CAS Name: 2-methyl-4-(4-methyl-1-piperazin-4-iumyl)-5-phenylthieno[2,3-d]pyrimidine IUPAC Name: 2-methyl-4-(4-methylpiperazin-4-ium-1-yl)-5-phenylthieno[2,3-d]pyrimidine Traditional Name: 2-methyl-4-(4-methylpiperazin-4-ium-1-yl)-5-phenyl-thieno[2,3-d]pyrimidine Formula: C18H21N4S+ MolecularWeight: 325.45114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C(=CSC2=N1)C3=CC=CC=C3)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=NC(=C2C(=CSC2=N1)C3=CC=CC=C3)N4CC[NH+](CC4)C

InChI

InChI=1S/C18H20N4S/c1-13-19-17(22-10-8-21(2)9-11-22)16-15(12-23-18(16)20-13)14-6-4-3-5-7-14/h3-7,12H,8-11H2,1-2H3/p+1