[2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethyl] 3-(naphthalen-2-ylsulfonylamino)propanoate

Systemtic Name: [2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethyl] 3-(naphthalen-2-ylsulfonylamino)propanoate Openeye Name: [2-(isobutylcarbamoylamino)-2-oxo-ethyl] 3-(2-naphthylsulfonylamino)propanoate CAS Name: 3-(2-naphthalenylsulfonylamino)propanoic acid [2-[[(2-methylpropylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(2-methylpropylcarbamoylamino)-2-oxoethyl] 3-(naphthalen-2-ylsulfonylamino)propanoate Traditional Name: 3-(2-naphthylsulfonylamino)propionic acid [2-(isobutylcarbamoylamino)-2-keto-ethyl] ester Formula: C20H25N3O6S MolecularWeight: 435.494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NC(=O)COC(=O)CCNS(=O)(=O)C1=CC2=CC=CC=C2C=C1

Isomeric SMILES

CC(C)CNC(=O)NC(=O)COC(=O)CCNS(=O)(=O)C1=CC2=CC=CC=C2C=C1

InChI

InChI=1S/C20H25N3O6S/c1-14(2)12-21-20(26)23-18(24)13-29-19(25)9-10-22-30(27,28)17-8-7-15-5-3-4-6-16(15)11-17/h3-8,11,14,22H,9-10,12-13H2,1-2H3,(H2,21,23,24,26)