5-methyl-4-(4-methylpiperazin-4-ium-1-yl)-N-[(1S)-1-thiophen-2-ylpropyl]thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 5-methyl-4-(4-methylpiperazin-4-ium-1-yl)-N-[(1S)-1-thiophen-2-ylpropyl]thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 5-methyl-4-(4-methylpiperazin-4-ium-1-yl)-N-[(1S)-1-(2-thienyl)propyl]thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 5-methyl-4-(4-methyl-1-piperazin-4-iumyl)-N-[(1S)-1-thiophen-2-ylpropyl]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 5-methyl-4-(4-methylpiperazin-4-ium-1-yl)-N-[(1S)-1-thiophen-2-ylpropyl]thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 5-methyl-4-(4-methylpiperazin-4-ium-1-yl)-N-[(1S)-1-(2-thienyl)propyl]thieno[2,3-d]pyrimidine-6-carboxamide Formula: C20H26N5OS2+ MolecularWeight: 416.58334

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CS1)NC(=O)C2=C(C3=C(N=CN=C3S2)N4CC[NH+](CC4)C)C

Isomeric SMILES

CC[C@@H](C1=CC=CS1)NC(=O)C2=C(C3=C(N=CN=C3S2)N4CC[NH+](CC4)C)C

InChI

InChI=1S/C20H25N5OS2/c1-4-14(15-6-5-11-27-15)23-19(26)17-13(2)16-18(21-12-22-20(16)28-17)25-9-7-24(3)8-10-25/h5-6,11-12,14H,4,7-10H2,1-3H3,(H,23,26)/p+1/t14-/m0/s1