6-[2-(3-chloranylpyridin-2-yl)sulfanylpropanoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-(3-chloranylpyridin-2-yl)sulfanylpropanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-[(3-chloro-2-pyridyl)sulfanyl]propanoyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-[(3-chloro-2-pyridinyl)thio]-1-oxopropyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(3-chloropyridin-2-yl)sulfanylpropanoyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-[(3-chloro-2-pyridyl)thio]propanoyl]-4H-1,4-benzoxazin-3-one Formula: C16H13ClN2O3S MolecularWeight: 348.80402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC2=C(C=C1)OCC(=O)N2)SC3=C(C=CC=N3)Cl

Isomeric SMILES

CC(C(=O)C1=CC2=C(C=C1)OCC(=O)N2)SC3=C(C=CC=N3)Cl

InChI

InChI=1S/C16H13ClN2O3S/c1-9(23-16-11(17)3-2-6-18-16)15(21)10-4-5-13-12(7-10)19-14(20)8-22-13/h2-7,9H,8H2,1H3,(H,19,20)