[2,5-dimethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidin-6-yl]-(4-propylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [2,5-dimethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidin-6-yl]-(4-propylpiperazin-4-ium-1-yl)methanone Openeye Name: [2,5-dimethyl-4-(2-methyl-1-piperidyl)thieno[2,3-d]pyrimidin-6-yl]-(4-propylpiperazin-4-ium-1-yl)methanone CAS Name: [2,5-dimethyl-4-(2-methyl-1-piperidinyl)-6-thieno[2,3-d]pyrimidinyl]-(4-propyl-1-piperazin-4-iumyl)methanone IUPAC Name: [2,5-dimethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidin-6-yl]-(4-propylpiperazin-4-ium-1-yl)methanone Traditional Name: [2,5-dimethyl-4-(2-methylpiperidino)thieno[2,3-d]pyrimidin-6-yl]-(4-propylpiperazin-4-ium-1-yl)methanone Formula: C22H34N5OS+ MolecularWeight: 416.60326

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C(=O)C2=C(C3=C(N=C(N=C3S2)C)N4CCCCC4C)C

Isomeric SMILES

CCC[NH+]1CCN(CC1)C(=O)C2=C(C3=C(N=C(N=C3S2)C)N4CCCCC4C)C

InChI

InChI=1S/C22H33N5OS/c1-5-9-25-11-13-26(14-12-25)22(28)19-16(3)18-20(23-17(4)24-21(18)29-19)27-10-7-6-8-15(27)2/h15H,5-14H2,1-4H3/p+1