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

Systemtic Name: 5-azanylidene-6-[[4-[(2-methylphenyl)methoxy]phenyl]methylidene]-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Openeye Name: 5-imino-6-[[4-(o-tolylmethoxy)phenyl]methylene]-2-(3-pyridyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one CAS Name: 5-imino-6-[[4-[(2-methylphenyl)methoxy]phenyl]methylidene]-2-(3-pyridinyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one IUPAC Name: 5-imino-6-[[4-[(2-methylphenyl)methoxy]phenyl]methylidene]-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Traditional Name: 5-imino-6-[4-(2-methylbenzyl)oxybenzylidene]-2-(3-pyridyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Formula: C25H19N5O2S MolecularWeight: 453.51566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1COC2=CC=C(C=C2)C=C3C(=N)N4C(=NC3=O)SC(=N4)C5=CN=CC=C5

Isomeric SMILES

CC1=CC=CC=C1COC2=CC=C(C=C2)C=C3C(=N)N4C(=NC3=O)SC(=N4)C5=CN=CC=C5

InChI

InChI=1S/C25H19N5O2S/c1-16-5-2-3-6-19(16)15-32-20-10-8-17(9-11-20)13-21-22(26)30-25(28-23(21)31)33-24(29-30)18-7-4-12-27-14-18/h2-14,26H,15H2,1H3