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

Systemtic Name: 4-(4-ethylpiperazin-4-ium-1-yl)-5,6-dimethyl-2-pyridin-3-yl-thieno[2,3-d]pyrimidine Openeye Name: 4-(4-ethylpiperazin-4-ium-1-yl)-5,6-dimethyl-2-(3-pyridyl)thieno[2,3-d]pyrimidine CAS Name: 4-(4-ethyl-1-piperazin-4-iumyl)-5,6-dimethyl-2-(3-pyridinyl)thieno[2,3-d]pyrimidine IUPAC Name: 4-(4-ethylpiperazin-4-ium-1-yl)-5,6-dimethyl-2-pyridin-3-ylthieno[2,3-d]pyrimidine Traditional Name: 4-(4-ethylpiperazin-4-ium-1-yl)-5,6-dimethyl-2-(3-pyridyl)thieno[2,3-d]pyrimidine Formula: C19H24N5S+ MolecularWeight: 354.49236

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C3C(=C(SC3=NC(=N2)C4=CN=CC=C4)C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C3C(=C(SC3=NC(=N2)C4=CN=CC=C4)C)C

InChI

InChI=1S/C19H23N5S/c1-4-23-8-10-24(11-9-23)18-16-13(2)14(3)25-19(16)22-17(21-18)15-6-5-7-20-12-15/h5-7,12H,4,8-11H2,1-3H3/p+1