[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(4-iodophenyl)methanone

Systemtic Name: [(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(4-iodophenyl)methanone Openeye Name: [(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]-(4-iodophenyl)methanone CAS Name: [(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-(4-iodophenyl)methanone IUPAC Name: [(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(4-iodophenyl)methanone Traditional Name: [(3S)-3-(1,3-benzothiazol-2-yl)piperidino]-(4-iodophenyl)methanone Formula: C19H17IN2OS MolecularWeight: 448.32055

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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