tert-butyl 3-[[1-(2,5-dimethylphenyl)sulfonylpiperidin-3-yl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[[1-(2,5-dimethylphenyl)sulfonylpiperidin-3-yl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[[1-(2,5-dimethylphenyl)sulfonyl-3-piperidyl]carbamoyl]piperidine-1-carboxylate CAS Name: 3-[[[1-(2,5-dimethylphenyl)sulfonyl-3-piperidinyl]amino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[1-(2,5-dimethylphenyl)sulfonylpiperidin-3-yl]carbamoyl]piperidine-1-carboxylate Traditional Name: 3-[[1-(2,5-dimethylphenyl)sulfonyl-3-piperidyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C24H37N3O5S MolecularWeight: 479.63268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCCC(C2)NC(=O)C3CCCN(C3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCCC(C2)NC(=O)C3CCCN(C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C24H37N3O5S/c1-17-10-11-18(2)21(14-17)33(30,31)27-13-7-9-20(16-27)25-22(28)19-8-6-12-26(15-19)23(29)32-24(3,4)5/h10-11,14,19-20H,6-9,12-13,15-16H2,1-5H3,(H,25,28)