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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)N4CC[NH+](CC4)C

InChI

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