[(2S)-1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 3-[phenyl(prop-2-enyl)sulfamoyl]benzoate

Systemtic Name: [(2S)-1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 3-[phenyl(prop-2-enyl)sulfamoyl]benzoate Openeye Name: [(1S)-2-(ethylcarbamoylamino)-1-methyl-2-oxo-ethyl] 3-[allyl(phenyl)sulfamoyl]benzoate CAS Name: 3-[phenyl(prop-2-enyl)sulfamoyl]benzoic acid [(2S)-1-(ethylcarbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(ethylcarbamoylamino)-1-oxopropan-2-yl] 3-[phenyl(prop-2-enyl)sulfamoyl]benzoate Traditional Name: 3-[allyl(phenyl)sulfamoyl]benzoic acid [(1S)-2-(ethylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C22H25N3O6S MolecularWeight: 459.5154

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C)OC(=O)C1=CC(=CC=C1)S(=O)(=O)N(CC=C)C2=CC=CC=C2

Isomeric SMILES

CCNC(=O)NC(=O)[C@H](C)OC(=O)C1=CC(=CC=C1)S(=O)(=O)N(CC=C)C2=CC=CC=C2

InChI

InChI=1S/C22H25N3O6S/c1-4-14-25(18-11-7-6-8-12-18)32(29,30)19-13-9-10-17(15-19)21(27)31-16(3)20(26)24-22(28)23-5-2/h4,6-13,15-16H,1,5,14H2,2-3H3,(H2,23,24,26,28)/t16-/m0/s1