ethyl 4-[(6-butyl-1,3-benzothiazol-2-yl)carbamoyl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(6-butyl-1,3-benzothiazol-2-yl)carbamoyl]piperidine-1-carboxylate Openeye Name: ethyl 4-[(6-butyl-1,3-benzothiazol-2-yl)carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[(6-butyl-1,3-benzothiazol-2-yl)amino]-oxomethyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(6-butyl-1,3-benzothiazol-2-yl)carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[(6-butyl-1,3-benzothiazol-2-yl)carbamoyl]piperidine-1-carboxylic acid ethyl ester Formula: C20H27N3O3S MolecularWeight: 389.51168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C20H27N3O3S/c1-3-5-6-14-7-8-16-17(13-14)27-19(21-16)22-18(24)15-9-11-23(12-10-15)20(25)26-4-2/h7-8,13,15H,3-6,9-12H2,1-2H3,(H,21,22,24)