2-methyl-3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanethioamide

Systemtic Name: 2-methyl-3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanethioamide Openeye Name: 2-methyl-3-(3-oxo-1,4-benzoxazin-4-yl)propanethioamide CAS Name: 2-methyl-3-(3-oxo-1,4-benzoxazin-4-yl)propanethioamide IUPAC Name: 2-methyl-3-(3-oxo-1,4-benzoxazin-4-yl)propanethioamide Traditional Name: 3-(3-keto-1,4-benzoxazin-4-yl)-2-methyl-thiopropionamide Formula: C12H14N2O2S MolecularWeight: 250.31676

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C(=O)COC2=CC=CC=C21)C(=S)N

Isomeric SMILES

CC(CN1C(=O)COC2=CC=CC=C21)C(=S)N

InChI

InChI=1S/C12H14N2O2S/c1-8(12(13)17)6-14-9-4-2-3-5-10(9)16-7-11(14)15/h2-5,8H,6-7H2,1H3,(H2,13,17)