(2R,3S)-3-bromanyl-N,N-diethyl-2-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanamide

Systemtic Name: (2R,3S)-3-bromanyl-N,N-diethyl-2-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanamide Openeye Name: (2R,3S)-3-bromo-N,N-diethyl-3-phenyl-2-(p-tolylsulfonylamino)propanamide CAS Name: (2R,3S)-3-bromo-N,N-diethyl-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanamide IUPAC Name: (2R,3S)-3-bromo-N,N-diethyl-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanamide Traditional Name: (2R,3S)-3-bromo-N,N-diethyl-3-phenyl-2-(tosylamino)propionamide Formula: C20H25BrN2O3S MolecularWeight: 453.3931

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(C(C1=CC=CC=C1)Br)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCN(CC)C(=O)[C@H]([C@H](C1=CC=CC=C1)Br)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C20H25BrN2O3S/c1-4-23(5-2)20(24)19(18(21)16-9-7-6-8-10-16)22-27(25,26)17-13-11-15(3)12-14-17/h6-14,18-19,22H,4-5H2,1-3H3/t18-,19-/m0/s1