2-oxidanylidene-2-(6-propylsulfanyl-1H-pyrrolo[2,3-b]pyridin-3-yl)ethanal

Systemtic Name: 2-oxidanylidene-2-(6-propylsulfanyl-1H-pyrrolo[2,3-b]pyridin-3-yl)ethanal Openeye Name: 2-oxo-2-(6-propylsulfanyl-1H-pyrrolo[2,3-b]pyridin-3-yl)acetaldehyde CAS Name: 2-oxo-2-[6-(propylthio)-1H-pyrrolo[2,3-b]pyridin-3-yl]acetaldehyde IUPAC Name: 2-oxo-2-(6-propylsulfanyl-1H-pyrrolo[2,3-b]pyridin-3-yl)acetaldehyde Traditional Name: 2-keto-2-[6-(propylthio)-1H-pyrrolo[2,3-b]pyridin-3-yl]acetaldehyde Formula: C12H12N2O2S MolecularWeight: 248.30088

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC2=C(C=C1)C(=CN2)C(=O)C=O

Isomeric SMILES

CCCSC1=NC2=C(C=C1)C(=CN2)C(=O)C=O

InChI

InChI=1S/C12H12N2O2S/c1-2-5-17-11-4-3-8-9(10(16)7-15)6-13-12(8)14-11/h3-4,6-7H,2,5H2,1H3,(H,13,14)