2-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)benzamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)benzamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-(3-oxo-4H-1,4-benzoxazin-6-yl)benzamide CAS Name: 2-[(1,3-benzothiazol-2-ylthio)methyl]-N-(3-oxo-4H-1,4-benzoxazin-6-yl)benzamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-(3-oxo-4H-1,4-benzoxazin-6-yl)benzamide Traditional Name: 2-[(1,3-benzothiazol-2-ylthio)methyl]-N-(3-keto-4H-1,4-benzoxazin-6-yl)benzamide Formula: C23H17N3O3S2 MolecularWeight: 447.52938

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)C3=CC=CC=C3CSC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)C3=CC=CC=C3CSC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H17N3O3S2/c27-21-12-29-19-10-9-15(11-18(19)25-21)24-22(28)16-6-2-1-5-14(16)13-30-23-26-17-7-3-4-8-20(17)31-23/h1-11H,12-13H2,(H,24,28)(H,25,27)