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

Systemtic Name: 2,6-dimethyl-5-(4-methylphenyl)-4-piperazin-4-ium-1-yl-thieno[2,3-d]pyrimidine Openeye Name: 2,6-dimethyl-4-piperazin-4-ium-1-yl-5-(p-tolyl)thieno[2,3-d]pyrimidine CAS Name: 2,6-dimethyl-5-(4-methylphenyl)-4-(1-piperazin-4-iumyl)thieno[2,3-d]pyrimidine IUPAC Name: 2,6-dimethyl-5-(4-methylphenyl)-4-piperazin-4-ium-1-ylthieno[2,3-d]pyrimidine Traditional Name: 2,6-dimethyl-4-piperazin-4-ium-1-yl-5-(p-tolyl)thieno[2,3-d]pyrimidine Formula: C19H23N4S+ MolecularWeight: 339.47772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC3=NC(=NC(=C23)N4CC[NH2+]CC4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC3=NC(=NC(=C23)N4CC[NH2+]CC4)C)C

InChI

InChI=1S/C19H22N4S/c1-12-4-6-15(7-5-12)16-13(2)24-19-17(16)18(21-14(3)22-19)23-10-8-20-9-11-23/h4-7,20H,8-11H2,1-3H3/p+1