4-[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]-1-piperazin-4-ium-1-yl-butan-1-one

Systemtic Name: 4-[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]-1-piperazin-4-ium-1-yl-butan-1-one Openeye Name: 4-[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]-1-piperazin-4-ium-1-yl-butan-1-one CAS Name: 4-[(6-methyl-4-thieno[2,3-d]pyrimidinyl)amino]-1-(1-piperazin-4-iumyl)-1-butanone IUPAC Name: 4-[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]-1-piperazin-4-ium-1-ylbutan-1-one Traditional Name: 4-[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]-1-piperazin-4-ium-1-yl-butan-1-one Formula: C15H22N5OS+ MolecularWeight: 320.43308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(N=CN=C2S1)NCCCC(=O)N3CC[NH2+]CC3

Isomeric SMILES

CC1=CC2=C(N=CN=C2S1)NCCCC(=O)N3CC[NH2+]CC3

InChI

InChI=1S/C15H21N5OS/c1-11-9-12-14(18-10-19-15(12)22-11)17-4-2-3-13(21)20-7-5-16-6-8-20/h9-10,16H,2-8H2,1H3,(H,17,18,19)/p+1