(2E,6E)-5-azanylidene-6-[[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-2-(2-morpholin-4-yl-2-oxidanylidene-ethylidene)-3H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Systemtic Name: (2E,6E)-5-azanylidene-6-[[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-2-(2-morpholin-4-yl-2-oxidanylidene-ethylidene)-3H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Openeye Name: (2E,6E)-6-[[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-5-imino-2-(2-morpholino-2-oxo-ethylidene)-3H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one CAS Name: (2E,6E)-6-[[1-(4-fluorophenyl)-2,5-dimethyl-3-pyrrolyl]methylidene]-5-imino-2-[2-(4-morpholinyl)-2-oxoethylidene]-3H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one IUPAC Name: (2E,6E)-6-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-5-imino-2-(2-morpholin-4-yl-2-oxoethylidene)-3H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Traditional Name: (2E,6E)-6-[[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-5-imino-2-(2-keto-2-morpholino-ethylidene)-3H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Formula: C24H23FN6O3S MolecularWeight: 494.541223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)F)C)C=C3C(=N)N4C(=NC3=O)SC(=CC(=O)N5CCOCC5)N4

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)F)C)/C=C/3\C(=N)N4C(=NC3=O)S/C(=C/C(=O)N5CCOCC5)/N4

InChI

InChI=1S/C24H23FN6O3S/c1-14-11-16(15(2)30(14)18-5-3-17(25)4-6-18)12-19-22(26)31-24(27-23(19)33)35-20(28-31)13-21(32)29-7-9-34-10-8-29/h3-6,11-13,26,28H,7-10H2,1-2H3/b19-12+,20-13+,26-22?