tert-butyl 4-[cyclopropyl(3-oxidanylidenebutyl)amino]-3-(naphthalen-2-ylsulfonylamino)-4-oxidanylidene-butanoate

Systemtic Name: tert-butyl 4-[cyclopropyl(3-oxidanylidenebutyl)amino]-3-(naphthalen-2-ylsulfonylamino)-4-oxidanylidene-butanoate Openeye Name: tert-butyl 4-[cyclopropyl(3-oxobutyl)amino]-3-(2-naphthylsulfonylamino)-4-oxo-butanoate CAS Name: 4-[cyclopropyl(3-oxobutyl)amino]-3-(2-naphthalenylsulfonylamino)-4-oxobutanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[cyclopropyl(3-oxobutyl)amino]-3-(naphthalen-2-ylsulfonylamino)-4-oxobutanoate Traditional Name: 4-[cyclopropyl(3-ketobutyl)amino]-4-keto-3-(2-naphthylsulfonylamino)butyric acid tert-butyl ester Formula: C25H32N2O6S MolecularWeight: 488.59638

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCN(C1CC1)C(=O)C(CC(=O)OC(C)(C)C)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC(=O)CCN(C1CC1)C(=O)C(CC(=O)OC(C)(C)C)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C25H32N2O6S/c1-17(28)13-14-27(20-10-11-20)24(30)22(16-23(29)33-25(2,3)4)26-34(31,32)21-12-9-18-7-5-6-8-19(18)15-21/h5-9,12,15,20,22,26H,10-11,13-14,16H2,1-4H3