5-azanyl-1-(3-pyridin-2-ylsulfanylpropyl)pyridin-2-one

Systemtic Name: 5-azanyl-1-(3-pyridin-2-ylsulfanylpropyl)pyridin-2-one Openeye Name: 5-amino-1-[3-(2-pyridylsulfanyl)propyl]pyridin-2-one CAS Name: 5-amino-1-[3-(2-pyridinylthio)propyl]-2-pyridinone IUPAC Name: 5-amino-1-(3-pyridin-2-ylsulfanylpropyl)pyridin-2-one Traditional Name: 5-amino-1-[3-(2-pyridylthio)propyl]-2-pyridone Formula: C13H15N3OS MolecularWeight: 261.3427

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)SCCCN2C=C(C=CC2=O)N

Isomeric SMILES

C1=CC=NC(=C1)SCCCN2C=C(C=CC2=O)N

InChI

InChI=1S/C13H15N3OS/c14-11-5-6-13(17)16(10-11)8-3-9-18-12-4-1-2-7-15-12/h1-2,4-7,10H,3,8-9,14H2