1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-(3-methylphenoxy)propan-1-one

Systemtic Name: 1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-(3-methylphenoxy)propan-1-one Openeye Name: 1-[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]-3-(3-methylphenoxy)propan-1-one CAS Name: 1-[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-3-(3-methylphenoxy)-1-propanone IUPAC Name: 1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-(3-methylphenoxy)propan-1-one Traditional Name: 1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidino]-3-(3-methylphenoxy)propan-1-one Formula: C22H24N2O2S MolecularWeight: 380.50316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCC(=O)N2CCCC(C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC(=CC=C1)OCCC(=O)N2CCC[C@H](C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H24N2O2S/c1-16-6-4-8-18(14-16)26-13-11-21(25)24-12-5-7-17(15-24)22-23-19-9-2-3-10-20(19)27-22/h2-4,6,8-10,14,17H,5,7,11-13,15H2,1H3/t17-/m1/s1