methyl 3-methyl-2-[[methyl-(phenylmethyl)amino]oxysulfinyl-(phenylmethyl)amino]butanoate

Systemtic Name: methyl 3-methyl-2-[[methyl-(phenylmethyl)amino]oxysulfinyl-(phenylmethyl)amino]butanoate Openeye Name: methyl 2-[benzyl-[benzyl(methyl)amino]oxysulfinyl-amino]-3-methyl-butanoate CAS Name: 3-methyl-2-[[methyl-(phenylmethyl)amino]oxysulfinyl-(phenylmethyl)amino]butanoic acid methyl ester IUPAC Name: methyl 2-[benzyl-[benzyl(methyl)amino]oxysulfinylamino]-3-methylbutanoate Traditional Name: 2-[benzyl-[benzyl(methyl)amino]oxysulfinyl-amino]-3-methyl-butyric acid methyl ester Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)N(CC1=CC=CC=C1)S(=O)ON(C)CC2=CC=CC=C2

Isomeric SMILES

CC(C)C(C(=O)OC)N(CC1=CC=CC=C1)S(=O)ON(C)CC2=CC=CC=C2

InChI

InChI=1S/C21H28N2O4S/c1-17(2)20(21(24)26-4)23(16-19-13-9-6-10-14-19)28(25)27-22(3)15-18-11-7-5-8-12-18/h5-14,17,20H,15-16H2,1-4H3