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

Systemtic Name: 5-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(3-ethoxypropyl)-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 5-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-9-methyl-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]methylene]-3-(3-ethoxypropyl)-2-thioxo-thiazolidin-4-one CAS Name: 5-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-9-methyl-4-oxo-3-pyrido[1,2-a]pyrimidinyl]methylidene]-3-(3-ethoxypropyl)-2-sulfanylidene-4-thiazolidinone IUPAC Name: 5-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(3-ethoxypropyl)-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 5-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-keto-9-methyl-pyrido[1,2-a]pyrimidin-3-yl]methylene]-3-(3-ethoxypropyl)-2-thioxo-thiazolidin-4-one Formula: C27H28N4O3S2 MolecularWeight: 520.66622

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=O)C(=CC2=C(N=C3C(=CC=CN3C2=O)C)N4CCC5=CC=CC=C5C4)SC1=S

Isomeric SMILES

CCOCCCN1C(=O)C(=CC2=C(N=C3C(=CC=CN3C2=O)C)N4CCC5=CC=CC=C5C4)SC1=S

InChI

InChI=1S/C27H28N4O3S2/c1-3-34-15-7-13-31-26(33)22(36-27(31)35)16-21-24(28-23-18(2)8-6-12-30(23)25(21)32)29-14-11-19-9-4-5-10-20(19)17-29/h4-6,8-10,12,16H,3,7,11,13-15,17H2,1-2H3