4-[(5Z)-5-[[2-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid

Systemtic Name: 4-[(5Z)-5-[[2-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid Openeye Name: 4-[(5Z)-5-[[2-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoic acid CAS Name: 4-[(5Z)-5-[[2-[4-(4-methoxyphenyl)-1-piperazinyl]-4-oxo-3-pyrido[1,2-a]pyrimidinyl]methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]butanoic acid IUPAC Name: 4-[(5Z)-5-[[2-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid Traditional Name: 4-[(5Z)-4-keto-5-[[4-keto-2-[4-(4-methoxyphenyl)piperazino]pyrido[1,2-a]pyrimidin-3-yl]methylene]-2-thioxo-thiazolidin-3-yl]butyric acid Formula: C27H27N5O5S2 MolecularWeight: 565.66378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C3=C(C(=O)N4C=CC=CC4=N3)C=C5C(=O)N(C(=S)S5)CCCC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C3=C(C(=O)N4C=CC=CC4=N3)/C=C\5/C(=O)N(C(=S)S5)CCCC(=O)O

InChI

InChI=1S/C27H27N5O5S2/c1-37-19-9-7-18(8-10-19)29-13-15-30(16-14-29)24-20(25(35)31-11-3-2-5-22(31)28-24)17-21-26(36)32(27(38)39-21)12-4-6-23(33)34/h2-3,5,7-11,17H,4,6,12-16H2,1H3,(H,33,34)/b21-17-