tert-butyl 4-[2-[4-[methyl(thiophen-2-ylsulfonyl)amino]phenoxy]ethanoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[4-[methyl(thiophen-2-ylsulfonyl)amino]phenoxy]ethanoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-[4-[methyl(2-thienylsulfonyl)amino]phenoxy]acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[4-[methyl(thiophen-2-ylsulfonyl)amino]phenoxy]-1-oxoethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[4-[methyl(thiophen-2-ylsulfonyl)amino]phenoxy]acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[4-[methyl(2-thienylsulfonyl)amino]phenoxy]acetyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C22H29N3O6S2 MolecularWeight: 495.61216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)COC2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)COC2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C22H29N3O6S2/c1-22(2,3)31-21(27)25-13-11-24(12-14-25)19(26)16-30-18-9-7-17(8-10-18)23(4)33(28,29)20-6-5-15-32-20/h5-10,15H,11-14,16H2,1-4H3