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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCC(=O)N2CCCC(C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=CC=C1OCCC(=O)N2CCC[C@H](C2)C3=NC4=CC=CC=C4S3

InChI

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