ethyl 4-[1,3-benzothiazol-2-yl(oxolan-2-ylmethyl)carbamoyl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[1,3-benzothiazol-2-yl(oxolan-2-ylmethyl)carbamoyl]piperidine-1-carboxylate Openeye Name: ethyl 4-[1,3-benzothiazol-2-yl(tetrahydrofuran-2-ylmethyl)carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[1,3-benzothiazol-2-yl(2-oxolanylmethyl)amino]-oxomethyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1,3-benzothiazol-2-yl(oxolan-2-ylmethyl)carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[1,3-benzothiazol-2-yl(tetrahydrofurfuryl)carbamoyl]piperidine-1-carboxylic acid ethyl ester Formula: C21H27N3O4S MolecularWeight: 417.52178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)C(=O)N(CC2CCCO2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC(=O)N1CCC(CC1)C(=O)N(CC2CCCO2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H27N3O4S/c1-2-27-21(26)23-11-9-15(10-12-23)19(25)24(14-16-6-5-13-28-16)20-22-17-7-3-4-8-18(17)29-20/h3-4,7-8,15-16H,2,5-6,9-14H2,1H3