2-[methyl-(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-1-(4-methylpiperazin-4-ium-1-yl)ethanone

Systemtic Name: 2-[methyl-(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-1-(4-methylpiperazin-4-ium-1-yl)ethanone Openeye Name: 2-[methyl-(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-1-(4-methylpiperazin-4-ium-1-yl)ethanone CAS Name: 2-[methyl-(6-phenyl-4-thieno[2,3-d]pyrimidinyl)amino]-1-(4-methyl-1-piperazin-4-iumyl)ethanone IUPAC Name: 2-[methyl-(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-1-(4-methylpiperazin-4-ium-1-yl)ethanone Traditional Name: 2-[methyl-(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-1-(4-methylpiperazin-4-ium-1-yl)ethanone Formula: C20H24N5OS+ MolecularWeight: 382.50246

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N5OS/c1-23-8-10-25(11-9-23)18(26)13-24(2)19-16-12-17(15-6-4-3-5-7-15)27-20(16)22-14-21-19/h3-7,12,14H,8-11,13H2,1-2H3/p+1