tert-butyl 4-(1-thiophen-2-ylsulfonylpiperidin-4-yl)carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(1-thiophen-2-ylsulfonylpiperidin-4-yl)carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[1-(2-thienylsulfonyl)piperidine-4-carbonyl]piperazine-1-carboxylate CAS Name: 4-[oxo-(1-thiophen-2-ylsulfonyl-4-piperidinyl)methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(1-thiophen-2-ylsulfonylpiperidine-4-carbonyl)piperazine-1-carboxylate Traditional Name: 4-[1-(2-thienylsulfonyl)isonipecotoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C19H29N3O5S2 MolecularWeight: 443.58066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C19H29N3O5S2/c1-19(2,3)27-18(24)21-12-10-20(11-13-21)17(23)15-6-8-22(9-7-15)29(25,26)16-5-4-14-28-16/h4-5,14-15H,6-13H2,1-3H3