(2S)-2-ethyl-N-(6-nitro-1,3-benzothiazol-2-yl)hexanamide

Systemtic Name: (2S)-2-ethyl-N-(6-nitro-1,3-benzothiazol-2-yl)hexanamide Openeye Name: (2S)-2-ethyl-N-(6-nitro-1,3-benzothiazol-2-yl)hexanamide CAS Name: (2S)-2-ethyl-N-(6-nitro-1,3-benzothiazol-2-yl)hexanamide IUPAC Name: (2S)-2-ethyl-N-(6-nitro-1,3-benzothiazol-2-yl)hexanamide Traditional Name: (2S)-2-ethyl-N-(6-nitro-1,3-benzothiazol-2-yl)hexanamide Formula: C15H19N3O3S MolecularWeight: 321.39466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCC[C@H](CC)C(=O)NC1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H19N3O3S/c1-3-5-6-10(4-2)14(19)17-15-16-12-8-7-11(18(20)21)9-13(12)22-15/h7-10H,3-6H2,1-2H3,(H,16,17,19)/t10-/m0/s1