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

Systemtic Name: ethyl 3-[(4-methyl-1,3-benzothiazol-2-yl)carbamoyl]piperidine-1-carboxylate Openeye Name: ethyl 3-[(4-methyl-1,3-benzothiazol-2-yl)carbamoyl]piperidine-1-carboxylate CAS Name: 3-[[(4-methyl-1,3-benzothiazol-2-yl)amino]-oxomethyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(4-methyl-1,3-benzothiazol-2-yl)carbamoyl]piperidine-1-carboxylate Traditional Name: 3-[(4-methyl-1,3-benzothiazol-2-yl)carbamoyl]piperidine-1-carboxylic acid ethyl ester Formula: C17H21N3O3S MolecularWeight: 347.43194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCCC(C1)C(=O)NC2=NC3=C(C=CC=C3S2)C

Isomeric SMILES

CCOC(=O)N1CCCC(C1)C(=O)NC2=NC3=C(C=CC=C3S2)C

InChI

InChI=1S/C17H21N3O3S/c1-3-23-17(22)20-9-5-7-12(10-20)15(21)19-16-18-14-11(2)6-4-8-13(14)24-16/h4,6,8,12H,3,5,7,9-10H2,1-2H3,(H,18,19,21)