5-chloranyl-2-[2-(4-methylphenyl)sulfanylpyridin-3-yl]-3,1-benzoxazin-4-one

Systemtic Name: 5-chloranyl-2-[2-(4-methylphenyl)sulfanylpyridin-3-yl]-3,1-benzoxazin-4-one Openeye Name: 5-chloro-2-[2-(p-tolylsulfanyl)-3-pyridyl]-3,1-benzoxazin-4-one CAS Name: 5-chloro-2-[2-[(4-methylphenyl)thio]-3-pyridinyl]-3,1-benzoxazin-4-one IUPAC Name: 5-chloro-2-[2-(4-methylphenyl)sulfanylpyridin-3-yl]-3,1-benzoxazin-4-one Traditional Name: 5-chloro-2-[2-(p-tolylthio)-3-pyridyl]-3,1-benzoxazin-4-one Formula: C20H13ClN2O2S MolecularWeight: 380.84742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=CC=N2)C3=NC4=C(C(=CC=C4)Cl)C(=O)O3

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=CC=N2)C3=NC4=C(C(=CC=C4)Cl)C(=O)O3

InChI

InChI=1S/C20H13ClN2O2S/c1-12-7-9-13(10-8-12)26-19-14(4-3-11-22-19)18-23-16-6-2-5-15(21)17(16)20(24)25-18/h2-11H,1H3