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

Systemtic Name: 1-[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(cyclooctylamino)ethanone Openeye Name: 1-[(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]-2-(cyclooctylamino)ethanone CAS Name: 1-[(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-2-(cyclooctylamino)ethanone IUPAC Name: 1-[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(cyclooctylamino)ethanone Traditional Name: 1-[(3S)-3-(1,3-benzothiazol-2-yl)piperidino]-2-(cyclooctylamino)ethanone Formula: C22H31N3OS MolecularWeight: 385.56604

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NCC(=O)N2CCCC(C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CCCC(CCC1)NCC(=O)N2CCC[C@@H](C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H31N3OS/c26-21(15-23-18-10-4-2-1-3-5-11-18)25-14-8-9-17(16-25)22-24-19-12-6-7-13-20(19)27-22/h6-7,12-13,17-18,23H,1-5,8-11,14-16H2/t17-/m0/s1