1-(1,3-benzothiazol-5-yl)-N-cinnolin-3-yl-piperidine-4-carboxamide

Systemtic Name: 1-(1,3-benzothiazol-5-yl)-N-cinnolin-3-yl-piperidine-4-carboxamide Openeye Name: 1-(1,3-benzothiazol-5-yl)-N-cinnolin-3-yl-piperidine-4-carboxamide CAS Name: 1-(1,3-benzothiazol-5-yl)-N-(3-cinnolinyl)-4-piperidinecarboxamide IUPAC Name: 1-(1,3-benzothiazol-5-yl)-N-cinnolin-3-ylpiperidine-4-carboxamide Traditional Name: 1-(1,3-benzothiazol-5-yl)-N-cinnolin-3-yl-isonipecotamide Formula: C21H19N5OS MolecularWeight: 389.47346

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=CC=CC=C3N=N2)C4=CC5=C(C=C4)SC=N5

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=CC=CC=C3N=N2)C4=CC5=C(C=C4)SC=N5

InChI

InChI=1S/C21H19N5OS/c27-21(23-20-11-15-3-1-2-4-17(15)24-25-20)14-7-9-26(10-8-14)16-5-6-19-18(12-16)22-13-28-19/h1-6,11-14H,7-10H2,(H,23,25,27)