tert-butyl (2R)-2-[(4-dimethylaminophenyl)sulfonyl-(phenylmethyl)amino]-3-methyl-butanoate

Systemtic Name: tert-butyl (2R)-2-[(4-dimethylaminophenyl)sulfonyl-(phenylmethyl)amino]-3-methyl-butanoate Openeye Name: tert-butyl (2R)-2-[benzyl-(4-dimethylaminophenyl)sulfonyl-amino]-3-methyl-butanoate CAS Name: (2R)-2-[(4-dimethylaminophenyl)sulfonyl-(phenylmethyl)amino]-3-methylbutanoic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-2-[benzyl-(4-dimethylaminophenyl)sulfonylamino]-3-methylbutanoate Traditional Name: (2R)-2-[benzyl-(4-dimethylaminophenyl)sulfonyl-amino]-3-methyl-butyric acid tert-butyl ester Formula: C24H34N2O4S MolecularWeight: 446.60276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC(C)(C)C)N(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)N(C)C

Isomeric SMILES

CC(C)[C@H](C(=O)OC(C)(C)C)N(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C24H34N2O4S/c1-18(2)22(23(27)30-24(3,4)5)26(17-19-11-9-8-10-12-19)31(28,29)21-15-13-20(14-16-21)25(6)7/h8-16,18,22H,17H2,1-7H3/t22-/m1/s1