5,6-dimethyl-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 5,6-dimethyl-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]thieno[2,3-d]pyrimidin-4-amine Openeye Name: 5,6-dimethyl-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]thieno[2,3-d]pyrimidin-4-amine CAS Name: 5,6-dimethyl-2-[(4-phenyl-1-piperazin-1-iumyl)methyl]-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 5,6-dimethyl-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]thieno[2,3-d]pyrimidin-4-amine Traditional Name: [5,6-dimethyl-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]thieno[2,3-d]pyrimidin-4-yl]amine Formula: C19H24N5S+ MolecularWeight: 354.49236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N)C[NH+]3CCN(CC3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N)C[NH+]3CCN(CC3)C4=CC=CC=C4)C

InChI

InChI=1S/C19H23N5S/c1-13-14(2)25-19-17(13)18(20)21-16(22-19)12-23-8-10-24(11-9-23)15-6-4-3-5-7-15/h3-7H,8-12H2,1-2H3,(H2,20,21,22)/p+1