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

Systemtic Name: [2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] 2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: [2-(butylcarbamoylamino)-2-oxo-ethyl] 2-[2-(dimethylamino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(dimethylamino)-2-oxoethyl]thio]benzoic acid [2-[[butylamino(oxo)methyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(butylcarbamoylamino)-2-oxoethyl] 2-[2-(dimethylamino)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-(dimethylamino)-2-keto-ethyl]thio]benzoic acid [2-(butylcarbamoylamino)-2-keto-ethyl] ester Formula: C18H25N3O5S MolecularWeight: 395.4732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N3O5S/c1-4-5-10-19-18(25)20-15(22)11-26-17(24)13-8-6-7-9-14(13)27-12-16(23)21(2)3/h6-9H,4-5,10-12H2,1-3H3,(H2,19,20,22,25)