1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-phenoxy-butan-1-one

Systemtic Name: 1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-phenoxy-butan-1-one Openeye Name: 1-[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]-4-phenoxy-butan-1-one CAS Name: 1-[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-4-phenoxy-1-butanone IUPAC Name: 1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-phenoxybutan-1-one Traditional Name: 1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidino]-4-phenoxy-butan-1-one Formula: C22H24N2O2S MolecularWeight: 380.50316

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CCCOC2=CC=CC=C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1C[C@H](CN(C1)C(=O)CCCOC2=CC=CC=C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H24N2O2S/c25-21(13-7-15-26-18-9-2-1-3-10-18)24-14-6-8-17(16-24)22-23-19-11-4-5-12-20(19)27-22/h1-5,9-12,17H,6-8,13-16H2/t17-/m1/s1