[2-(cyclopropylamino)-2-oxidanylidene-ethyl] 2-benzamido-4-methylsulfonyl-butanoate

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-ethyl] 2-benzamido-4-methylsulfonyl-butanoate Openeye Name: [2-(cyclopropylamino)-2-oxo-ethyl] 2-benzamido-4-methylsulfonyl-butanoate CAS Name: 2-benzamido-4-methylsulfonylbutanoic acid [2-(cyclopropylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxoethyl] 2-benzamido-4-methylsulfonylbutanoate Traditional Name: 2-benzamido-4-mesyl-butyric acid [2-(cyclopropylamino)-2-keto-ethyl] ester Formula: C17H22N2O6S MolecularWeight: 382.43138

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)OCC(=O)NC1CC1)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)CCC(C(=O)OCC(=O)NC1CC1)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H22N2O6S/c1-26(23,24)10-9-14(19-16(21)12-5-3-2-4-6-12)17(22)25-11-15(20)18-13-7-8-13/h2-6,13-14H,7-11H2,1H3,(H,18,20)(H,19,21)