N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-(6-chloranylpyridazin-3-yl)piperidine-4-carboxamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-(6-chloranylpyridazin-3-yl)piperidine-4-carboxamide Openeye Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-(6-chloropyridazin-3-yl)piperidine-4-carboxamide CAS Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-(6-chloro-3-pyridazinyl)-4-piperidinecarboxamide IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-(6-chloropyridazin-3-yl)piperidine-4-carboxamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-(6-chloropyridazin-3-yl)isonipecotamide Formula: C23H20ClN5OS MolecularWeight: 449.9558

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4S3)C5=NN=C(C=C5)Cl

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4S3)C5=NN=C(C=C5)Cl

InChI

InChI=1S/C23H20ClN5OS/c24-20-9-10-21(28-27-20)29-13-11-15(12-14-29)22(30)25-17-7-5-16(6-8-17)23-26-18-3-1-2-4-19(18)31-23/h1-10,15H,11-14H2,(H,25,30)