1-(1,3-benzothiazol-2-yl)-N'-(3-nitrophenyl)carbonyl-piperidine-3-carbohydrazide

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-N'-(3-nitrophenyl)carbonyl-piperidine-3-carbohydrazide Openeye Name: 1-(1,3-benzothiazol-2-yl)-N'-(3-nitrobenzoyl)piperidine-3-carbohydrazide CAS Name: 1-(1,3-benzothiazol-2-yl)-N'-[(3-nitrophenyl)-oxomethyl]-3-piperidinecarbohydrazide IUPAC Name: 1-(1,3-benzothiazol-2-yl)-N'-(3-nitrobenzoyl)piperidine-3-carbohydrazide Traditional Name: 1-(1,3-benzothiazol-2-yl)-N'-(3-nitrobenzoyl)nipecotohydrazide Formula: C20H19N5O4S MolecularWeight: 425.46096

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC3=CC=CC=C3S2)C(=O)NNC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC(CN(C1)C2=NC3=CC=CC=C3S2)C(=O)NNC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O4S/c26-18(13-5-3-7-15(11-13)25(28)29)22-23-19(27)14-6-4-10-24(12-14)20-21-16-8-1-2-9-17(16)30-20/h1-3,5,7-9,11,14H,4,6,10,12H2,(H,22,26)(H,23,27)