1-[2-[(6-nitro-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-[(6-nitro-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxamide Openeye Name: 1-[2-[(6-nitro-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl]piperidine-4-carboxamide CAS Name: 1-[2-[(6-nitro-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-[(6-nitro-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]piperidine-4-carboxamide Traditional Name: 1-[2-keto-2-[(6-nitro-1,3-benzothiazol-2-yl)amino]ethyl]isonipecotamide Formula: C15H17N5O4S MolecularWeight: 363.39158

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)CC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)N)CC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H17N5O4S/c16-14(22)9-3-5-19(6-4-9)8-13(21)18-15-17-11-2-1-10(20(23)24)7-12(11)25-15/h1-2,7,9H,3-6,8H2,(H2,16,22)(H,17,18,21)