[2-(cyclohexylmethylamino)-2-oxidanylidene-ethyl] 2-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: [2-(cyclohexylmethylamino)-2-oxidanylidene-ethyl] 2-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: [2-(cyclohexylmethylamino)-2-oxo-ethyl] 2-[2-(cyclopropylamino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(cyclopropylamino)-2-oxoethyl]thio]benzoic acid [2-(cyclohexylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclohexylmethylamino)-2-oxoethyl] 2-[2-(cyclopropylamino)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-(cyclopropylamino)-2-keto-ethyl]thio]benzoic acid [2-(cyclohexylmethylamino)-2-keto-ethyl] ester Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=O)COC(=O)C2=CC=CC=C2SCC(=O)NC3CC3

Isomeric SMILES

C1CCC(CC1)CNC(=O)COC(=O)C2=CC=CC=C2SCC(=O)NC3CC3

InChI

InChI=1S/C21H28N2O4S/c24-19(22-12-15-6-2-1-3-7-15)13-27-21(26)17-8-4-5-9-18(17)28-14-20(25)23-16-10-11-16/h4-5,8-9,15-16H,1-3,6-7,10-14H2,(H,22,24)(H,23,25)