3-(6-azanylpyridin-3-yl)sulfanylazepan-2-one

Systemtic Name: 3-(6-azanylpyridin-3-yl)sulfanylazepan-2-one Openeye Name: 3-[(6-amino-3-pyridyl)sulfanyl]azepan-2-one CAS Name: 3-[(6-amino-3-pyridinyl)thio]-2-azepanone IUPAC Name: 3-(6-aminopyridin-3-yl)sulfanylazepan-2-one Traditional Name: 3-[(6-amino-3-pyridyl)thio]azepan-2-one Formula: C11H15N3OS MolecularWeight: 237.3213

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)SC2=CN=C(C=C2)N

Isomeric SMILES

C1CCNC(=O)C(C1)SC2=CN=C(C=C2)N

InChI

InChI=1S/C11H15N3OS/c12-10-5-4-8(7-14-10)16-9-3-1-2-6-13-11(9)15/h4-5,7,9H,1-3,6H2,(H2,12,14)(H,13,15)