1-(2,2-dimethylpropanoyl)-N-(6-nitro-1,3-benzothiazol-2-yl)piperidine-4-carboxamide

Systemtic Name: 1-(2,2-dimethylpropanoyl)-N-(6-nitro-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Openeye Name: 1-(2,2-dimethylpropanoyl)-N-(6-nitro-1,3-benzothiazol-2-yl)piperidine-4-carboxamide CAS Name: 1-(2,2-dimethyl-1-oxopropyl)-N-(6-nitro-1,3-benzothiazol-2-yl)-4-piperidinecarboxamide IUPAC Name: 1-(2,2-dimethylpropanoyl)-N-(6-nitro-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Traditional Name: N-(6-nitro-1,3-benzothiazol-2-yl)-1-pivaloyl-isonipecotamide Formula: C18H22N4O4S MolecularWeight: 390.45668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N1CCC(CC1)C(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C(=O)N1CCC(CC1)C(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O4S/c1-18(2,3)16(24)21-8-6-11(7-9-21)15(23)20-17-19-13-5-4-12(22(25)26)10-14(13)27-17/h4-5,10-11H,6-9H2,1-3H3,(H,19,20,23)