(5Z)-5-[[2-(1,3-benzodioxol-5-ylmethylamino)-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(phenylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: (5Z)-5-[[2-(1,3-benzodioxol-5-ylmethylamino)-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(phenylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: (5Z)-5-[[2-(1,3-benzodioxol-5-ylmethylamino)-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]methylene]-3-benzyl-2-thioxo-thiazolidin-4-one CAS Name: (5Z)-5-[[2-(1,3-benzodioxol-5-ylmethylamino)-4-oxo-3-pyrido[1,2-a]pyrimidinyl]methylidene]-3-(phenylmethyl)-2-sulfanylidene-4-thiazolidinone IUPAC Name: (5Z)-5-[[2-(1,3-benzodioxol-5-ylmethylamino)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-benzyl-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: (5Z)-3-benzyl-5-[[4-keto-2-(piperonylamino)pyrido[1,2-a]pyrimidin-3-yl]methylene]-2-thioxo-thiazolidin-4-one Formula: C27H20N4O4S2 MolecularWeight: 528.6021

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=C(C(=O)N4C=CC=CC4=N3)C=C5C(=O)N(C(=S)S5)CC6=CC=CC=C6

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=C(C(=O)N4C=CC=CC4=N3)/C=C\5/C(=O)N(C(=S)S5)CC6=CC=CC=C6

InChI

InChI=1S/C27H20N4O4S2/c32-25-19(13-22-26(33)31(27(36)37-22)15-17-6-2-1-3-7-17)24(29-23-8-4-5-11-30(23)25)28-14-18-9-10-20-21(12-18)35-16-34-20/h1-13,28H,14-16H2/b22-13-