1-[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(4-propoxyphenoxy)ethanone

Systemtic Name: 1-[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(4-propoxyphenoxy)ethanone Openeye Name: 1-[(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]-2-(4-propoxyphenoxy)ethanone CAS Name: 1-[(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-2-(4-propoxyphenoxy)ethanone IUPAC Name: 1-[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(4-propoxyphenoxy)ethanone Traditional Name: 1-[(3S)-3-(1,3-benzothiazol-2-yl)piperidino]-2-(4-propoxyphenoxy)ethanone Formula: C23H26N2O3S MolecularWeight: 410.52914

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)OCC(=O)N2CCCC(C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCOC1=CC=C(C=C1)OCC(=O)N2CCC[C@@H](C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H26N2O3S/c1-2-14-27-18-9-11-19(12-10-18)28-16-22(26)25-13-5-6-17(15-25)23-24-20-7-3-4-8-21(20)29-23/h3-4,7-12,17H,2,5-6,13-16H2,1H3/t17-/m0/s1