(6Z)-5-azanylidene-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-6-[(5-phenylfuran-2-yl)methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Systemtic Name: (6Z)-5-azanylidene-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-6-[(5-phenylfuran-2-yl)methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Openeye Name: (6Z)-5-imino-2-[2-oxo-2-(1-piperidyl)ethyl]-6-[(5-phenyl-2-furyl)methylene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one CAS Name: (6Z)-5-imino-2-[2-oxo-2-(1-piperidinyl)ethyl]-6-[(5-phenyl-2-furanyl)methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one IUPAC Name: (6Z)-5-imino-2-(2-oxo-2-piperidin-1-ylethyl)-6-[(5-phenylfuran-2-yl)methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Traditional Name: (6Z)-5-imino-2-(2-keto-2-piperidino-ethyl)-6-[(5-phenyl-2-furyl)methylene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Formula: C23H21N5O3S MolecularWeight: 447.50954

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CC2=NN3C(=N)C(=CC4=CC=C(O4)C5=CC=CC=C5)C(=O)N=C3S2

Isomeric SMILES

C1CCN(CC1)C(=O)CC2=NN3C(=N)/C(=C/C4=CC=C(O4)C5=CC=CC=C5)/C(=O)N=C3S2

InChI

InChI=1S/C23H21N5O3S/c24-21-17(13-16-9-10-18(31-16)15-7-3-1-4-8-15)22(30)25-23-28(21)26-19(32-23)14-20(29)27-11-5-2-6-12-27/h1,3-4,7-10,13,24H,2,5-6,11-12,14H2/b17-13-,24-21?