N-[1-(4-ethylphenyl)ethyl]-2-[(5-nitro-1,3-benzoxazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[1-(4-ethylphenyl)ethyl]-2-[(5-nitro-1,3-benzoxazol-2-yl)sulfanyl]ethanamide Openeye Name: N-[1-(4-ethylphenyl)ethyl]-2-[(5-nitro-1,3-benzoxazol-2-yl)sulfanyl]acetamide CAS Name: N-[1-(4-ethylphenyl)ethyl]-2-[(5-nitro-1,3-benzoxazol-2-yl)thio]acetamide IUPAC Name: N-[1-(4-ethylphenyl)ethyl]-2-[(5-nitro-1,3-benzoxazol-2-yl)sulfanyl]acetamide Traditional Name: N-[1-(4-ethylphenyl)ethyl]-2-[(5-nitro-1,3-benzoxazol-2-yl)thio]acetamide Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C)NC(=O)CSC2=NC3=C(O2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C(C)NC(=O)CSC2=NC3=C(O2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O4S/c1-3-13-4-6-14(7-5-13)12(2)20-18(23)11-27-19-21-16-10-15(22(24)25)8-9-17(16)26-19/h4-10,12H,3,11H2,1-2H3,(H,20,23)