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

Systemtic Name: N,N-bis(2-methylpropyl)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanamide Openeye Name: N,N-diisobutyl-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide CAS Name: N,N-bis(2-methylpropyl)-2-[(6-nitro-1,3-benzothiazol-2-yl)thio]acetamide IUPAC Name: N,N-bis(2-methylpropyl)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide Traditional Name: N,N-diisobutyl-2-[(6-nitro-1,3-benzothiazol-2-yl)thio]acetamide Formula: C17H23N3O3S2 MolecularWeight: 381.51282

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N3O3S2/c1-11(2)8-19(9-12(3)4)16(21)10-24-17-18-14-6-5-13(20(22)23)7-15(14)25-17/h5-7,11-12H,8-10H2,1-4H3