2-[5-methyl-6-(4-methylpiperazin-4-ium-1-yl)carbonyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]-N-propyl-ethanamide

Systemtic Name: 2-[5-methyl-6-(4-methylpiperazin-4-ium-1-yl)carbonyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]-N-propyl-ethanamide Openeye Name: 2-[5-methyl-6-(4-methylpiperazin-4-ium-1-carbonyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]-N-propyl-acetamide CAS Name: 2-[5-methyl-6-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]-4-oxo-3-thieno[2,3-d]pyrimidinyl]-N-propylacetamide IUPAC Name: 2-[5-methyl-6-(4-methylpiperazin-4-ium-1-carbonyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]-N-propylacetamide Traditional Name: 2-[4-keto-5-methyl-6-(4-methylpiperazin-4-ium-1-carbonyl)thieno[2,3-d]pyrimidin-3-yl]-N-propyl-acetamide Formula: C18H26N5O3S+ MolecularWeight: 392.49574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN1C=NC2=C(C1=O)C(=C(S2)C(=O)N3CC[NH+](CC3)C)C

Isomeric SMILES

CCCNC(=O)CN1C=NC2=C(C1=O)C(=C(S2)C(=O)N3CC[NH+](CC3)C)C

InChI

InChI=1S/C18H25N5O3S/c1-4-5-19-13(24)10-23-11-20-16-14(17(23)25)12(2)15(27-16)18(26)22-8-6-21(3)7-9-22/h11H,4-10H2,1-3H3,(H,19,24)/p+1