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

Systemtic Name: 6-[2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanylethanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanylacetyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-[[1-(3-chlorophenyl)-2-imidazolyl]thio]-1-oxoethyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanylacetyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-[[1-(3-chlorophenyl)imidazol-2-yl]thio]acetyl]-4H-1,4-benzoxazin-3-one Formula: C19H14ClN3O3S MolecularWeight: 399.85076

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(O1)C=CC(=C2)C(=O)CSC3=NC=CN3C4=CC(=CC=C4)Cl

Isomeric SMILES

C1C(=O)NC2=C(O1)C=CC(=C2)C(=O)CSC3=NC=CN3C4=CC(=CC=C4)Cl

InChI

InChI=1S/C19H14ClN3O3S/c20-13-2-1-3-14(9-13)23-7-6-21-19(23)27-11-16(24)12-4-5-17-15(8-12)22-18(25)10-26-17/h1-9H,10-11H2,(H,22,25)