tert-butyl N-[1-[(1-methylsulfonylpiperidin-4-yl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-[(1-methylsulfonylpiperidin-4-yl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-benzyl-2-[(1-methylsulfonyl-4-piperidyl)amino]-2-oxo-ethyl]carbamate CAS Name: N-[1-[(1-methylsulfonyl-4-piperidinyl)amino]-1-oxo-3-phenylpropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[(1-methylsulfonylpiperidin-4-yl)amino]-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[1-benzyl-2-keto-2-[(1-mesyl-4-piperidyl)amino]ethyl]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)NC(CC1=CC=CC=C1)C(=O)NC2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)NC2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C20H31N3O5S/c1-20(2,3)28-19(25)22-17(14-15-8-6-5-7-9-15)18(24)21-16-10-12-23(13-11-16)29(4,26)27/h5-9,16-17H,10-14H2,1-4H3,(H,21,24)(H,22,25)