6-[2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]propanoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]propanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-(4-phenylthiazol-2-yl)sulfanylpropanoyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[1-oxo-2-[(4-phenyl-2-thiazolyl)thio]propyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]propanoyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-[(4-phenylthiazol-2-yl)thio]propanoyl]-4H-1,4-benzoxazin-3-one Formula: C20H16N2O3S2 MolecularWeight: 396.48264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC2=C(C=C1)OCC(=O)N2)SC3=NC(=CS3)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)C1=CC2=C(C=C1)OCC(=O)N2)SC3=NC(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C20H16N2O3S2/c1-12(27-20-22-16(11-26-20)13-5-3-2-4-6-13)19(24)14-7-8-17-15(9-14)21-18(23)10-25-17/h2-9,11-12H,10H2,1H3,(H,21,23)