(5Z)-2-methylsulfanyl-5-[1-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethylidene]-1H-imidazol-4-one

Systemtic Name: (5Z)-2-methylsulfanyl-5-[1-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethylidene]-1H-imidazol-4-one Openeye Name: (5Z)-2-methylsulfanyl-5-[1-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethylidene]-1H-imidazol-4-one CAS Name: (5Z)-2-(methylthio)-5-[1-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethylidene]-1H-imidazol-4-one IUPAC Name: (5Z)-2-methylsulfanyl-5-[1-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethylidene]-1H-imidazol-4-one Traditional Name: (5Z)-2-(methylthio)-5-[1-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethylidene]-2-imidazolin-4-one Formula: C13H12N4OS MolecularWeight: 272.32558

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C(=O)N=C(N1)SC)C2=CNC3=C2C=CC=N3

Isomeric SMILES

C/C(=C/1\C(=O)N=C(N1)SC)/C2=CNC3=C2C=CC=N3

InChI

InChI=1S/C13H12N4OS/c1-7(10-12(18)17-13(16-10)19-2)9-6-15-11-8(9)4-3-5-14-11/h3-6H,1-2H3,(H,14,15)(H,16,17,18)/b10-7-