ethyl 4-[[1-(1,3-benzothiazol-2-yl)piperidin-3-yl]amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[1-(1,3-benzothiazol-2-yl)piperidin-3-yl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[1-(1,3-benzothiazol-2-yl)-3-piperidyl]amino]piperidine-1-carboxylate CAS Name: 4-[[1-(1,3-benzothiazol-2-yl)-3-piperidinyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[1-(1,3-benzothiazol-2-yl)piperidin-3-yl]amino]piperidine-1-carboxylate Traditional Name: 4-[[1-(1,3-benzothiazol-2-yl)-3-piperidyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C20H28N4O2S MolecularWeight: 388.52692

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC2CCCN(C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC2CCCN(C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H28N4O2S/c1-2-26-20(25)23-12-9-15(10-13-23)21-16-6-5-11-24(14-16)19-22-17-7-3-4-8-18(17)27-19/h3-4,7-8,15-16,21H,2,5-6,9-14H2,1H3