N-(4-methylsulfanylphenyl)-2-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)ethanamide

Systemtic Name: N-(4-methylsulfanylphenyl)-2-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)ethanamide Openeye Name: N-(4-methylsulfanylphenyl)-2-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)acetamide CAS Name: N-[4-(methylthio)phenyl]-2-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)acetamide IUPAC Name: N-(4-methylsulfanylphenyl)-2-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)acetamide Traditional Name: 2-(2-keto-6-nitro-1,3-benzoxazol-3-yl)-N-[4-(methylthio)phenyl]acetamide Formula: C16H13N3O5S MolecularWeight: 359.35652

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)CN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)CN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

InChI

InChI=1S/C16H13N3O5S/c1-25-12-5-2-10(3-6-12)17-15(20)9-18-13-7-4-11(19(22)23)8-14(13)24-16(18)21/h2-8H,9H2,1H3,(H,17,20)