6-[2-[1-(phenylmethyl)imidazol-2-yl]sulfanylethanoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-[1-(phenylmethyl)imidazol-2-yl]sulfanylethanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-(1-benzylimidazol-2-yl)sulfanylacetyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[1-oxo-2-[[1-(phenylmethyl)-2-imidazolyl]thio]ethyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(1-benzylimidazol-2-yl)sulfanylacetyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-[(1-benzylimidazol-2-yl)thio]acetyl]-4H-1,4-benzoxazin-3-one Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(O1)C=CC(=C2)C(=O)CSC3=NC=CN3CC4=CC=CC=C4

Isomeric SMILES

C1C(=O)NC2=C(O1)C=CC(=C2)C(=O)CSC3=NC=CN3CC4=CC=CC=C4

InChI

InChI=1S/C20H17N3O3S/c24-17(15-6-7-18-16(10-15)22-19(25)12-26-18)13-27-20-21-8-9-23(20)11-14-4-2-1-3-5-14/h1-10H,11-13H2,(H,22,25)