(6Z)-5-azanylidene-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-6-[[4-(2-phenoxyethoxy)phenyl]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-[[4-(2-phenoxyethoxy)phenyl]methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Openeye Name: (6Z)-5-imino-2-[2-oxo-2-(1-piperidyl)ethyl]-6-[[4-(2-phenoxyethoxy)phenyl]methylene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one CAS Name: (6Z)-5-imino-2-[2-oxo-2-(1-piperidinyl)ethyl]-6-[[4-(2-phenoxyethoxy)phenyl]methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one IUPAC Name: (6Z)-5-imino-2-(2-oxo-2-piperidin-1-ylethyl)-6-[[4-(2-phenoxyethoxy)phenyl]methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Traditional Name: (6Z)-5-imino-2-(2-keto-2-piperidino-ethyl)-6-[4-(2-phenoxyethoxy)benzylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Formula: C27H27N5O4S MolecularWeight: 517.59938

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CC2=NN3C(=N)C(=CC4=CC=C(C=C4)OCCOC5=CC=CC=C5)C(=O)N=C3S2

Isomeric SMILES

C1CCN(CC1)C(=O)CC2=NN3C(=N)/C(=C/C4=CC=C(C=C4)OCCOC5=CC=CC=C5)/C(=O)N=C3S2

InChI

InChI=1S/C27H27N5O4S/c28-25-22(17-19-9-11-21(12-10-19)36-16-15-35-20-7-3-1-4-8-20)26(34)29-27-32(25)30-23(37-27)18-24(33)31-13-5-2-6-14-31/h1,3-4,7-12,17,28H,2,5-6,13-16,18H2/b22-17-,28-25?