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

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

CCC1=C(C2=C(N=CN=C2S1)N3CC[NH2+]CC3)C4=CC=C(C=C4)C

Isomeric SMILES

CCC1=C(C2=C(N=CN=C2S1)N3CC[NH2+]CC3)C4=CC=C(C=C4)C

InChI

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