4-methyl-6-[2-(6-methylpyrimidin-4-yl)sulfanylpropanoyl]-1,4-benzoxazin-3-one

Systemtic Name: 4-methyl-6-[2-(6-methylpyrimidin-4-yl)sulfanylpropanoyl]-1,4-benzoxazin-3-one Openeye Name: 4-methyl-6-[2-(6-methylpyrimidin-4-yl)sulfanylpropanoyl]-1,4-benzoxazin-3-one CAS Name: 4-methyl-6-[2-[(6-methyl-4-pyrimidinyl)thio]-1-oxopropyl]-1,4-benzoxazin-3-one IUPAC Name: 4-methyl-6-[2-(6-methylpyrimidin-4-yl)sulfanylpropanoyl]-1,4-benzoxazin-3-one Traditional Name: 4-methyl-6-[2-[(6-methylpyrimidin-4-yl)thio]propanoyl]-1,4-benzoxazin-3-one Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=N1)SC(C)C(=O)C2=CC3=C(C=C2)OCC(=O)N3C

Isomeric SMILES

CC1=CC(=NC=N1)SC(C)C(=O)C2=CC3=C(C=C2)OCC(=O)N3C

InChI

InChI=1S/C17H17N3O3S/c1-10-6-15(19-9-18-10)24-11(2)17(22)12-4-5-14-13(7-12)20(3)16(21)8-23-14/h4-7,9,11H,8H2,1-3H3