3-(1,3-benzothiazol-2-yl)-N-[(2S)-2-(furan-2-yl)-2-piperidin-1-yl-ethyl]propanamide

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-[(2S)-2-(furan-2-yl)-2-piperidin-1-yl-ethyl]propanamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-[(2S)-2-(2-furyl)-2-(1-piperidyl)ethyl]propanamide CAS Name: 3-(1,3-benzothiazol-2-yl)-N-[(2S)-2-(2-furanyl)-2-(1-piperidinyl)ethyl]propanamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-N-[(2S)-2-(2-furyl)-2-piperidino-ethyl]propionamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(CNC(=O)CCC2=NC3=CC=CC=C3S2)C4=CC=CO4

Isomeric SMILES

C1CCN(CC1)[C@@H](CNC(=O)CCC2=NC3=CC=CC=C3S2)C4=CC=CO4

InChI

InChI=1S/C21H25N3O2S/c25-20(10-11-21-23-16-7-2-3-9-19(16)27-21)22-15-17(18-8-6-14-26-18)24-12-4-1-5-13-24/h2-3,6-9,14,17H,1,4-5,10-13,15H2,(H,22,25)/t17-/m0/s1