tert-butyl N-[(2R)-1-[(3-chlorophenyl)amino]-3-ethylsulfonyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2R)-1-[(3-chlorophenyl)amino]-3-ethylsulfonyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1R)-1-[(3-chloroanilino)methyl]-2-ethylsulfonyl-ethyl]carbamate CAS Name: N-[(2R)-1-(3-chloroanilino)-3-ethylsulfonylpropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2R)-1-(3-chloroanilino)-3-ethylsulfonylpropan-2-yl]carbamate Traditional Name: N-[(1R)-1-[(3-chloroanilino)methyl]-2-esyl-ethyl]carbamic acid tert-butyl ester Formula: C16H25ClN2O4S MolecularWeight: 376.8987

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)CC(CNC1=CC(=CC=C1)Cl)NC(=O)OC(C)(C)C

Isomeric SMILES

CCS(=O)(=O)C[C@@H](CNC1=CC(=CC=C1)Cl)NC(=O)OC(C)(C)C

InChI

InChI=1S/C16H25ClN2O4S/c1-5-24(21,22)11-14(19-15(20)23-16(2,3)4)10-18-13-8-6-7-12(17)9-13/h6-9,14,18H,5,10-11H2,1-4H3,(H,19,20)/t14-/m1/s1