(5Z)-5-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-pentyl-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: (5Z)-5-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-pentyl-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: (5Z)-5-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-9-methyl-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]methylene]-3-pentyl-2-thioxo-thiazolidin-4-one CAS Name: (5Z)-5-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-9-methyl-4-oxo-3-pyrido[1,2-a]pyrimidinyl]methylidene]-3-pentyl-2-sulfanylidene-4-thiazolidinone IUPAC Name: (5Z)-5-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-pentyl-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: (5Z)-3-amyl-5-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-keto-9-methyl-pyrido[1,2-a]pyrimidin-3-yl]methylene]-2-thioxo-thiazolidin-4-one Formula: C27H28N4O2S2 MolecularWeight: 504.66682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C(=CC2=C(N=C3C(=CC=CN3C2=O)C)N4CCC5=CC=CC=C5C4)SC1=S

Isomeric SMILES

CCCCCN1C(=O)/C(=C/C2=C(N=C3C(=CC=CN3C2=O)C)N4CCC5=CC=CC=C5C4)/SC1=S

InChI

InChI=1S/C27H28N4O2S2/c1-3-4-7-13-31-26(33)22(35-27(31)34)16-21-24(28-23-18(2)9-8-14-30(23)25(21)32)29-15-12-19-10-5-6-11-20(19)17-29/h5-6,8-11,14,16H,3-4,7,12-13,15,17H2,1-2H3/b22-16-