5-azanyl-6-pyridin-4-ylsulfanyl-2,3-dihydroinden-1-one

Systemtic Name: 5-azanyl-6-pyridin-4-ylsulfanyl-2,3-dihydroinden-1-one Openeye Name: 5-amino-6-(4-pyridylsulfanyl)indan-1-one CAS Name: 5-amino-6-(pyridin-4-ylthio)-2,3-dihydroinden-1-one IUPAC Name: 5-amino-6-pyridin-4-ylsulfanyl-2,3-dihydroinden-1-one Traditional Name: 5-amino-6-(4-pyridylthio)indan-1-one Formula: C14H12N2OS MolecularWeight: 256.32288

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C2=CC(=C(C=C21)N)SC3=CC=NC=C3

Isomeric SMILES

C1CC(=O)C2=CC(=C(C=C21)N)SC3=CC=NC=C3

InChI

InChI=1S/C14H12N2OS/c15-12-7-9-1-2-13(17)11(9)8-14(12)18-10-3-5-16-6-4-10/h3-8H,1-2,15H2