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

Systemtic Name: 5-(3,4-dimethylphenyl)-4-(4-methylpiperazin-4-ium-1-yl)thieno[2,3-d]pyrimidine Openeye Name: 5-(3,4-dimethylphenyl)-4-(4-methylpiperazin-4-ium-1-yl)thieno[2,3-d]pyrimidine CAS Name: 5-(3,4-dimethylphenyl)-4-(4-methyl-1-piperazin-4-iumyl)thieno[2,3-d]pyrimidine IUPAC Name: 5-(3,4-dimethylphenyl)-4-(4-methylpiperazin-4-ium-1-yl)thieno[2,3-d]pyrimidine Traditional Name: 5-(3,4-dimethylphenyl)-4-(4-methylpiperazin-4-ium-1-yl)thieno[2,3-d]pyrimidine Formula: C19H23N4S+ MolecularWeight: 339.47772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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