tert-butyl N-[4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butyl]carbamate

Systemtic Name: tert-butyl N-[4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butyl]carbamate Openeye Name: tert-butyl N-[4-oxo-4-[4-(p-tolylsulfonyl)piperazin-1-yl]butyl]carbamate CAS Name: N-[4-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-4-oxobutyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-oxobutyl]carbamate Traditional Name: N-[4-keto-4-(4-tosylpiperazino)butyl]carbamic acid tert-butyl ester Formula: C20H31N3O5S MolecularWeight: 425.54224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCCNC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCCNC(=O)OC(C)(C)C

InChI

InChI=1S/C20H31N3O5S/c1-16-7-9-17(10-8-16)29(26,27)23-14-12-22(13-15-23)18(24)6-5-11-21-19(25)28-20(2,3)4/h7-10H,5-6,11-15H2,1-4H3,(H,21,25)