2-[3-(furan-2-ylmethyl)-5-[(3-nitro-4-pyrimidin-2-ylsulfanyl-phenyl)methylidene]-4-oxidanylidene-1,3-thiazolidin-2-ylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile

Systemtic Name: 2-[3-(furan-2-ylmethyl)-5-[(3-nitro-4-pyrimidin-2-ylsulfanyl-phenyl)methylidene]-4-oxidanylidene-1,3-thiazolidin-2-ylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile Openeye Name: 2-[3-(2-furylmethyl)-5-[(3-nitro-4-pyrimidin-2-ylsulfanyl-phenyl)methylene]-4-oxo-thiazolidin-2-ylidene]-4,4-dimethyl-3-oxo-pentanenitrile CAS Name: 2-[3-(2-furanylmethyl)-5-[[3-nitro-4-(2-pyrimidinylthio)phenyl]methylidene]-4-oxo-2-thiazolidinylidene]-4,4-dimethyl-3-oxopentanenitrile IUPAC Name: 2-[3-(furan-2-ylmethyl)-5-[(3-nitro-4-pyrimidin-2-ylsulfanylphenyl)methylidene]-4-oxo-1,3-thiazolidin-2-ylidene]-4,4-dimethyl-3-oxopentanenitrile Traditional Name: 2-[3-(2-furfuryl)-4-keto-5-[3-nitro-4-(2-pyrimidylthio)benzylidene]thiazolidin-2-ylidene]-3-keto-4,4-dimethyl-valeronitrile Formula: C26H21N5O5S2 MolecularWeight: 547.60544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(=C1N(C(=O)C(=CC2=CC(=C(C=C2)SC3=NC=CC=N3)[N+](=O)[O-])S1)CC4=CC=CO4)C#N

Isomeric SMILES

CC(C)(C)C(=O)C(=C1N(C(=O)C(=CC2=CC(=C(C=C2)SC3=NC=CC=N3)[N+](=O)[O-])S1)CC4=CC=CO4)C#N

InChI

InChI=1S/C26H21N5O5S2/c1-26(2,3)22(32)18(14-27)24-30(15-17-6-4-11-36-17)23(33)21(37-24)13-16-7-8-20(19(12-16)31(34)35)38-25-28-9-5-10-29-25/h4-13H,15H2,1-3H3