N,N-diethyl-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N,N-diethyl-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanamide Openeye Name: N,N-diethyl-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide CAS Name: N,N-diethyl-2-[(6-nitro-1,3-benzothiazol-2-yl)thio]acetamide IUPAC Name: N,N-diethyl-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide Traditional Name: N,N-diethyl-2-[(6-nitro-1,3-benzothiazol-2-yl)thio]acetamide Formula: C13H15N3O3S2 MolecularWeight: 325.4065

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CSC1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C(=O)CSC1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O3S2/c1-3-15(4-2)12(17)8-20-13-14-10-6-5-9(16(18)19)7-11(10)21-13/h5-7H,3-4,8H2,1-2H3