3-ethyl-5-[[2-(4-ethylpiperazin-1-yl)-9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 3-ethyl-5-[[2-(4-ethylpiperazin-1-yl)-9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 3-ethyl-5-[[2-(4-ethylpiperazin-1-yl)-9-methyl-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]methylene]-2-thioxo-thiazolidin-4-one CAS Name: 3-ethyl-5-[[2-(4-ethyl-1-piperazinyl)-9-methyl-4-oxo-3-pyrido[1,2-a]pyrimidinyl]methylidene]-2-sulfanylidene-4-thiazolidinone IUPAC Name: 3-ethyl-5-[[2-(4-ethylpiperazin-1-yl)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 3-ethyl-5-[[2-(4-ethylpiperazino)-4-keto-9-methyl-pyrido[1,2-a]pyrimidin-3-yl]methylene]-2-thioxo-thiazolidin-4-one Formula: C21H25N5O2S2 MolecularWeight: 443.5855

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C(=O)N3C=CC=C(C3=N2)C)C=C4C(=O)N(C(=S)S4)CC

Isomeric SMILES

CCN1CCN(CC1)C2=C(C(=O)N3C=CC=C(C3=N2)C)C=C4C(=O)N(C(=S)S4)CC

InChI

InChI=1S/C21H25N5O2S2/c1-4-23-9-11-24(12-10-23)18-15(13-16-20(28)25(5-2)21(29)30-16)19(27)26-8-6-7-14(3)17(26)22-18/h6-8,13H,4-5,9-12H2,1-3H3