[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(5-chloranyl-1-benzofuran-2-yl)methanone

Systemtic Name: [(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(5-chloranyl-1-benzofuran-2-yl)methanone Openeye Name: [(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]-(5-chlorobenzofuran-2-yl)methanone CAS Name: [(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-(5-chloro-2-benzofuranyl)methanone IUPAC Name: [(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(5-chloro-1-benzofuran-2-yl)methanone Traditional Name: [(3S)-3-(1,3-benzothiazol-2-yl)piperidino]-(5-chlorobenzofuran-2-yl)methanone Formula: C21H17ClN2O2S MolecularWeight: 396.88988

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC3=C(O2)C=CC(=C3)Cl)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)C2=CC3=C(O2)C=CC(=C3)Cl)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C21H17ClN2O2S/c22-15-7-8-17-14(10-15)11-18(26-17)21(25)24-9-3-4-13(12-24)20-23-16-5-1-2-6-19(16)27-20/h1-2,5-8,10-11,13H,3-4,9,12H2/t13-/m0/s1