(5Z)-5-[(9-methyl-4-oxidanylidene-2-phenylsulfanyl-pyrido[1,2-a]pyrimidin-3-yl)methylidene]-3-octyl-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: (5Z)-5-[(9-methyl-4-oxidanylidene-2-phenylsulfanyl-pyrido[1,2-a]pyrimidin-3-yl)methylidene]-3-octyl-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: (5Z)-5-[(9-methyl-4-oxo-2-phenylsulfanyl-pyrido[1,2-a]pyrimidin-3-yl)methylene]-3-octyl-2-thioxo-thiazolidin-4-one CAS Name: (5Z)-5-[[9-methyl-4-oxo-2-(phenylthio)-3-pyrido[1,2-a]pyrimidinyl]methylidene]-3-octyl-2-sulfanylidene-4-thiazolidinone IUPAC Name: (5Z)-5-[(9-methyl-4-oxo-2-phenylsulfanylpyrido[1,2-a]pyrimidin-3-yl)methylidene]-3-octyl-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: (5Z)-5-[[4-keto-9-methyl-2-(phenylthio)pyrido[1,2-a]pyrimidin-3-yl]methylene]-3-octyl-2-thioxo-thiazolidin-4-one Formula: C27H29N3O2S3 MolecularWeight: 523.73306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C(=O)C(=CC2=C(N=C3C(=CC=CN3C2=O)C)SC4=CC=CC=C4)SC1=S

Isomeric SMILES

CCCCCCCCN1C(=O)/C(=C/C2=C(N=C3C(=CC=CN3C2=O)C)SC4=CC=CC=C4)/SC1=S

InChI

InChI=1S/C27H29N3O2S3/c1-3-4-5-6-7-11-16-30-26(32)22(35-27(30)33)18-21-24(34-20-14-9-8-10-15-20)28-23-19(2)13-12-17-29(23)25(21)31/h8-10,12-15,17-18H,3-7,11,16H2,1-2H3/b22-18-