methyl 2-[[3-methylbutyl(naphthalen-1-ylsulfonyl)amino]methyl]-1,3-oxazole-4-carboxylate

Systemtic Name: methyl 2-[[3-methylbutyl(naphthalen-1-ylsulfonyl)amino]methyl]-1,3-oxazole-4-carboxylate Openeye Name: methyl 2-[[isopentyl(1-naphthylsulfonyl)amino]methyl]oxazole-4-carboxylate CAS Name: 2-[[3-methylbutyl(1-naphthalenylsulfonyl)amino]methyl]-4-oxazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[3-methylbutyl(naphthalen-1-ylsulfonyl)amino]methyl]-1,3-oxazole-4-carboxylate Traditional Name: 2-[[isoamyl(1-naphthylsulfonyl)amino]methyl]oxazole-4-carboxylic acid methyl ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CC1=NC(=CO1)C(=O)OC)S(=O)(=O)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC(C)CCN(CC1=NC(=CO1)C(=O)OC)S(=O)(=O)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C21H24N2O5S/c1-15(2)11-12-23(13-20-22-18(14-28-20)21(24)27-3)29(25,26)19-10-6-8-16-7-4-5-9-17(16)19/h4-10,14-15H,11-13H2,1-3H3