[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 2-[2-(dimethylamino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(dimethylamino)-2-oxoethyl]thio]benzoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 2-[2-(dimethylamino)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-(dimethylamino)-2-keto-ethyl]thio]benzoic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C18H26N2O4S MolecularWeight: 366.47504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N2O4S/c1-5-13(6-2)19-16(21)11-24-18(23)14-9-7-8-10-15(14)25-12-17(22)20(3)4/h7-10,13H,5-6,11-12H2,1-4H3,(H,19,21)