[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(3-iodanylphenyl)methanone

Systemtic Name: [(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(3-iodanylphenyl)methanone Openeye Name: [(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]-(3-iodophenyl)methanone CAS Name: [(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-(3-iodophenyl)methanone IUPAC Name: [(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(3-iodophenyl)methanone Traditional Name: [(3S)-3-(1,3-benzothiazol-2-yl)piperidino]-(3-iodophenyl)methanone Formula: C19H17IN2OS MolecularWeight: 448.32055

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC(=CC=C2)I)C3=NC4=CC=CC=C4S3

Isomeric SMILES

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

InChI

InChI=1S/C19H17IN2OS/c20-15-7-3-5-13(11-15)19(23)22-10-4-6-14(12-22)18-21-16-8-1-2-9-17(16)24-18/h1-3,5,7-9,11,14H,4,6,10,12H2/t14-/m0/s1