[2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: [2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 2-[2-(dimethylamino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(dimethylamino)-2-oxoethyl]thio]benzoic acid [2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 2-[2-(dimethylamino)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-(dimethylamino)-2-keto-ethyl]thio]benzoic acid [2-keto-2-(propylcarbamoylamino)ethyl] ester Formula: C17H23N3O5S MolecularWeight: 381.44662

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)COC(=O)C1=CC=CC=C1SCC(=O)N(C)C

Isomeric SMILES

CCCNC(=O)NC(=O)COC(=O)C1=CC=CC=C1SCC(=O)N(C)C

InChI

InChI=1S/C17H23N3O5S/c1-4-9-18-17(24)19-14(21)10-25-16(23)12-7-5-6-8-13(12)26-11-15(22)20(2)3/h5-8H,4,9-11H2,1-3H3,(H2,18,19,21,24)