ethyl 2-[2-oxidanylidene-2-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethyl]sulfanylethanoate

Systemtic Name: ethyl 2-[2-oxidanylidene-2-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethyl]sulfanylethanoate Openeye Name: ethyl 2-[2-oxo-2-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethyl]sulfanylacetate CAS Name: 2-[[2-oxo-2-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-oxo-2-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethyl]thio]acetic acid ethyl ester Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC(=O)N1C(COC2=CC=CC=C21)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CSCC(=O)N1C(COC2=CC=CC=C21)C3=CC=CC=C3

InChI

InChI=1S/C20H21NO4S/c1-2-24-20(23)14-26-13-19(22)21-16-10-6-7-11-18(16)25-12-17(21)15-8-4-3-5-9-15/h3-11,17H,2,12-14H2,1H3