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

Systemtic Name: N-butan-2-yl-2-[(5-nitro-1,3-benzoxazol-2-yl)sulfanyl]ethanamide Openeye Name: 2-[(5-nitro-1,3-benzoxazol-2-yl)sulfanyl]-N-sec-butyl-acetamide CAS Name: N-butan-2-yl-2-[(5-nitro-1,3-benzoxazol-2-yl)thio]acetamide IUPAC Name: N-butan-2-yl-2-[(5-nitro-1,3-benzoxazol-2-yl)sulfanyl]acetamide Traditional Name: 2-[(5-nitro-1,3-benzoxazol-2-yl)thio]-N-sec-butyl-acetamide Formula: C13H15N3O4S MolecularWeight: 309.3409

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CSC1=NC2=C(O1)C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CCC(C)NC(=O)CSC1=NC2=C(O1)C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O4S/c1-3-8(2)14-12(17)7-21-13-15-10-6-9(16(18)19)4-5-11(10)20-13/h4-6,8H,3,7H2,1-2H3,(H,14,17)