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

Systemtic Name: 5-(3,4-dimethylphenyl)-4-(4-ethylpiperazin-4-ium-1-yl)thieno[2,3-d]pyrimidine Openeye Name: 5-(3,4-dimethylphenyl)-4-(4-ethylpiperazin-4-ium-1-yl)thieno[2,3-d]pyrimidine CAS Name: 5-(3,4-dimethylphenyl)-4-(4-ethyl-1-piperazin-4-iumyl)thieno[2,3-d]pyrimidine IUPAC Name: 5-(3,4-dimethylphenyl)-4-(4-ethylpiperazin-4-ium-1-yl)thieno[2,3-d]pyrimidine Traditional Name: 5-(3,4-dimethylphenyl)-4-(4-ethylpiperazin-4-ium-1-yl)thieno[2,3-d]pyrimidine Formula: C20H25N4S+ MolecularWeight: 353.5043

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C3C(=CSC3=NC=N2)C4=CC(=C(C=C4)C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C3C(=CSC3=NC=N2)C4=CC(=C(C=C4)C)C

InChI

InChI=1S/C20H24N4S/c1-4-23-7-9-24(10-8-23)19-18-17(12-25-20(18)22-13-21-19)16-6-5-14(2)15(3)11-16/h5-6,11-13H,4,7-10H2,1-3H3/p+1