tert-butyl N-[3-oxidanylidene-3-[(4-piperidin-1-ylsulfonylphenyl)methylamino]propyl]carbamate

Systemtic Name: tert-butyl N-[3-oxidanylidene-3-[(4-piperidin-1-ylsulfonylphenyl)methylamino]propyl]carbamate Openeye Name: tert-butyl N-[3-oxo-3-[[4-(1-piperidylsulfonyl)phenyl]methylamino]propyl]carbamate CAS Name: N-[3-oxo-3-[[4-(1-piperidinylsulfonyl)phenyl]methylamino]propyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-oxo-3-[(4-piperidin-1-ylsulfonylphenyl)methylamino]propyl]carbamate Traditional Name: N-[3-keto-3-[(4-piperidinosulfonylbenzyl)amino]propyl]carbamic acid tert-butyl ester Formula: C20H31N3O5S MolecularWeight: 425.54224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC(=O)NCC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CC(C)(C)OC(=O)NCCC(=O)NCC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2

InChI

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