N-(4-ethoxy-2-nitro-phenyl)-2-[(5-ethylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-ethoxy-2-nitro-phenyl)-2-[(5-ethylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]ethanamide Openeye Name: N-(4-ethoxy-2-nitro-phenyl)-2-[(5-ethylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]acetamide CAS Name: N-(4-ethoxy-2-nitrophenyl)-2-[(5-ethylsulfonyl-1,3-benzoxazol-2-yl)thio]acetamide IUPAC Name: N-(4-ethoxy-2-nitrophenyl)-2-[(5-ethylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]acetamide Traditional Name: 2-[(5-esyl-1,3-benzoxazol-2-yl)thio]-N-(4-ethoxy-2-nitro-phenyl)acetamide Formula: C19H19N3O7S2 MolecularWeight: 465.50006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=O)CSC2=NC3=C(O2)C=CC(=C3)S(=O)(=O)CC)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=O)CSC2=NC3=C(O2)C=CC(=C3)S(=O)(=O)CC)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O7S2/c1-3-28-12-5-7-14(16(9-12)22(24)25)20-18(23)11-30-19-21-15-10-13(31(26,27)4-2)6-8-17(15)29-19/h5-10H,3-4,11H2,1-2H3,(H,20,23)