5-azanylidene-6-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-2-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Systemtic Name: 5-azanylidene-6-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-2-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Openeye Name: 5-imino-6-[[5-(4-nitrophenyl)-2-furyl]methylene]-2-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one CAS Name: 5-imino-6-[[5-(4-nitrophenyl)-2-furanyl]methylidene]-2-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one IUPAC Name: 5-imino-6-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-2-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Traditional Name: 5-imino-6-[[5-(4-nitrophenyl)-2-furyl]methylene]-2-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Formula: C22H13N5O4S MolecularWeight: 443.43472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN3C(=N)C(=CC4=CC=C(O4)C5=CC=C(C=C5)[N+](=O)[O-])C(=O)N=C3S2

Isomeric SMILES

C1=CC=C(C=C1)C2=NN3C(=N)C(=CC4=CC=C(O4)C5=CC=C(C=C5)[N+](=O)[O-])C(=O)N=C3S2

InChI

InChI=1S/C22H13N5O4S/c23-19-17(12-16-10-11-18(31-16)13-6-8-15(9-7-13)27(29)30)20(28)24-22-26(19)25-21(32-22)14-4-2-1-3-5-14/h1-12,23H