2-(1,3-benzodioxol-5-yl)-N-[(3S)-1-(1,3-benzothiazol-2-yl)piperidin-3-yl]ethanamide

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-[(3S)-1-(1,3-benzothiazol-2-yl)piperidin-3-yl]ethanamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-[(3S)-1-(1,3-benzothiazol-2-yl)-3-piperidyl]acetamide CAS Name: 2-(1,3-benzodioxol-5-yl)-N-[(3S)-1-(1,3-benzothiazol-2-yl)-3-piperidinyl]acetamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-[(3S)-1-(1,3-benzothiazol-2-yl)piperidin-3-yl]acetamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-N-[(3S)-1-(1,3-benzothiazol-2-yl)-3-piperidyl]acetamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC3=CC=CC=C3S2)NC(=O)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1C[C@@H](CN(C1)C2=NC3=CC=CC=C3S2)NC(=O)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H21N3O3S/c25-20(11-14-7-8-17-18(10-14)27-13-26-17)22-15-4-3-9-24(12-15)21-23-16-5-1-2-6-19(16)28-21/h1-2,5-8,10,15H,3-4,9,11-13H2,(H,22,25)/t15-/m0/s1