(5Z)-5-[(4-oxidanylidene-2-pyrrolidin-1-yl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)methylidene]-3-pentyl-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: (5Z)-5-[(4-oxidanylidene-2-pyrrolidin-1-yl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)methylidene]-3-pentyl-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: (5Z)-5-[(4-oxo-2-pyrrolidin-1-yl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)methylene]-3-pentyl-2-thioxo-thiazolidin-4-one CAS Name: (5Z)-5-[[4-oxo-2-(1-pyrrolidinyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]methylidene]-3-pentyl-2-sulfanylidene-4-thiazolidinone IUPAC Name: (5Z)-5-[(4-oxo-2-pyrrolidin-1-yl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)methylidene]-3-pentyl-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: (5Z)-3-amyl-5-[(4-keto-2-pyrrolidino-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)methylene]-2-thioxo-thiazolidin-4-one Formula: C21H25N4O2S2+ MolecularWeight: 429.5788

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C(=CC2=C(NC3=CC=CC=[N+]3C2=O)N4CCCC4)SC1=S

Isomeric SMILES

CCCCCN1C(=O)/C(=C/C2=C(NC3=CC=CC=[N+]3C2=O)N4CCCC4)/SC1=S

InChI

InChI=1S/C21H24N4O2S2/c1-2-3-5-13-25-20(27)16(29-21(25)28)14-15-18(23-10-7-8-11-23)22-17-9-4-6-12-24(17)19(15)26/h4,6,9,12,14H,2-3,5,7-8,10-11,13H2,1H3/p+1/b16-14-