N-[2-[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]-4-chloranyl-pyridine-2-carboxamide

Systemtic Name: N-[2-[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]-4-chloranyl-pyridine-2-carboxamide Openeye Name: N-[2-[(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]-2-oxo-ethyl]-4-chloro-pyridine-2-carboxamide CAS Name: N-[2-[(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-2-oxoethyl]-4-chloro-2-pyridinecarboxamide IUPAC Name: N-[2-[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxoethyl]-4-chloropyridine-2-carboxamide Traditional Name: N-[2-[(3S)-3-(1,3-benzothiazol-2-yl)piperidino]-2-keto-ethyl]-4-chloro-picolinamide Formula: C20H19ClN4O2S MolecularWeight: 414.90846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CNC(=O)C2=NC=CC(=C2)Cl)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)CNC(=O)C2=NC=CC(=C2)Cl)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H19ClN4O2S/c21-14-7-8-22-16(10-14)19(27)23-11-18(26)25-9-3-4-13(12-25)20-24-15-5-1-2-6-17(15)28-20/h1-2,5-8,10,13H,3-4,9,11-12H2,(H,23,27)/t13-/m0/s1