5-ethyl-6-methyl-3-(3-morpholin-4-ium-4-ylpropyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-ethyl-6-methyl-3-(3-morpholin-4-ium-4-ylpropyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-ethyl-6-methyl-3-(3-morpholin-4-ium-4-ylpropyl)-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-ethyl-6-methyl-3-[3-(4-morpholin-4-iumyl)propyl]-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-ethyl-6-methyl-3-(3-morpholin-4-ium-4-ylpropyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-ethyl-6-methyl-3-(3-morpholin-4-ium-4-ylpropyl)-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one Formula: C16H24N3O2S2+ MolecularWeight: 354.51066

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)N(C(=S)N2)CCC[NH+]3CCOCC3)C

Isomeric SMILES

CCC1=C(SC2=C1C(=O)N(C(=S)N2)CCC[NH+]3CCOCC3)C

InChI

InChI=1S/C16H23N3O2S2/c1-3-12-11(2)23-14-13(12)15(20)19(16(22)17-14)6-4-5-18-7-9-21-10-8-18/h3-10H2,1-2H3,(H,17,22)/p+1