5-azanylidene-6-[(3-methoxy-4-propan-2-yloxy-phenyl)methylidene]-2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-3H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Systemtic Name: 5-azanylidene-6-[(3-methoxy-4-propan-2-yloxy-phenyl)methylidene]-2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-3H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Openeye Name: 5-imino-6-[(4-isopropoxy-3-methoxy-phenyl)methylene]-2-(4-oxocyclohexa-2,5-dien-1-ylidene)-3H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one CAS Name: 5-imino-6-[(3-methoxy-4-propan-2-yloxyphenyl)methylidene]-2-(4-oxo-1-cyclohexa-2,5-dienylidene)-3H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one IUPAC Name: 5-imino-6-[(3-methoxy-4-propan-2-yloxyphenyl)methylidene]-2-(4-oxocyclohexa-2,5-dien-1-ylidene)-3H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Traditional Name: 5-imino-6-(4-isopropoxy-3-methoxy-benzylidene)-2-(4-ketocyclohexa-2,5-dien-1-ylidene)-3H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Formula: C22H20N4O4S MolecularWeight: 436.4836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C=C2C(=N)N3C(=NC2=O)SC(=C4C=CC(=O)C=C4)N3)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C=C2C(=N)N3C(=NC2=O)SC(=C4C=CC(=O)C=C4)N3)OC

InChI

InChI=1S/C22H20N4O4S/c1-12(2)30-17-9-4-13(11-18(17)29-3)10-16-19(23)26-22(24-20(16)28)31-21(25-26)14-5-7-15(27)8-6-14/h4-12,23,25H,1-3H3