N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanamide Openeye Name: N-(3-tert-butylisoxazol-5-yl)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide CAS Name: N-(3-tert-butyl-5-isoxazolyl)-2-[(6-nitro-1,3-benzothiazol-2-yl)thio]acetamide IUPAC Name: N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide Traditional Name: N-(3-tert-butylisoxazol-5-yl)-2-[(6-nitro-1,3-benzothiazol-2-yl)thio]acetamide Formula: C16H16N4O4S2 MolecularWeight: 392.45264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NOC(=C1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=NOC(=C1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H16N4O4S2/c1-16(2,3)12-7-14(24-19-12)18-13(21)8-25-15-17-10-5-4-9(20(22)23)6-11(10)26-15/h4-7H,8H2,1-3H3,(H,18,21)