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

Systemtic Name: N-(4,5-dimethyl-2-nitro-phenyl)-2-[(5-ethylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]ethanamide Openeye Name: N-(4,5-dimethyl-2-nitro-phenyl)-2-[(5-ethylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]acetamide CAS Name: N-(4,5-dimethyl-2-nitrophenyl)-2-[(5-ethylsulfonyl-1,3-benzoxazol-2-yl)thio]acetamide IUPAC Name: N-(4,5-dimethyl-2-nitrophenyl)-2-[(5-ethylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]acetamide Traditional Name: N-(4,5-dimethyl-2-nitro-phenyl)-2-[(5-esyl-1,3-benzoxazol-2-yl)thio]acetamide Formula: C19H19N3O6S2 MolecularWeight: 449.50066

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCC(=O)NC3=C(C=C(C(=C3)C)C)[N+](=O)[O-]

Isomeric SMILES

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCC(=O)NC3=C(C=C(C(=C3)C)C)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O6S2/c1-4-30(26,27)13-5-6-17-15(9-13)21-19(28-17)29-10-18(23)20-14-7-11(2)12(3)8-16(14)22(24)25/h5-9H,4,10H2,1-3H3,(H,20,23)