1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-(4-phenyldiazenylphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-(4-phenyldiazenylphenyl)piperidine-4-carboxamide Openeye Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-(4-phenylazophenyl)piperidine-4-carboxamide CAS Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-(4-phenyldiazenylphenyl)-4-piperidinecarboxamide IUPAC Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-(4-phenyldiazenylphenyl)piperidine-4-carboxamide Traditional Name: 1-(1,1-diketo-1,2-benzothiazol-3-yl)-N-(4-phenylazophenyl)isonipecotamide Formula: C25H23N5O3S MolecularWeight: 473.54682

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=C(C=C2)N=NC3=CC=CC=C3)C4=NS(=O)(=O)C5=CC=CC=C54

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=C(C=C2)N=NC3=CC=CC=C3)C4=NS(=O)(=O)C5=CC=CC=C54

InChI

InChI=1S/C25H23N5O3S/c31-25(26-19-10-12-21(13-11-19)28-27-20-6-2-1-3-7-20)18-14-16-30(17-15-18)24-22-8-4-5-9-23(22)34(32,33)29-24/h1-13,18H,14-17H2,(H,26,31)