[2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxidanylidene-ethyl] 2-(thiophen-3-ylcarbonylamino)benzoate

Systemtic Name: [2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxidanylidene-ethyl] 2-(thiophen-3-ylcarbonylamino)benzoate Openeye Name: [2-[(1-morpholinocyclohexyl)methylamino]-2-oxo-ethyl] 2-(thiophene-3-carbonylamino)benzoate CAS Name: 2-[[oxo(3-thiophenyl)methyl]amino]benzoic acid [2-[[1-(4-morpholinyl)cyclohexyl]methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxoethyl] 2-(thiophene-3-carbonylamino)benzoate Traditional Name: 2-(3-thenoylamino)benzoic acid [2-keto-2-[(1-morpholinocyclohexyl)methylamino]ethyl] ester Formula: C25H31N3O5S MolecularWeight: 485.59574

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)COC(=O)C2=CC=CC=C2NC(=O)C3=CSC=C3)N4CCOCC4

Isomeric SMILES

C1CCC(CC1)(CNC(=O)COC(=O)C2=CC=CC=C2NC(=O)C3=CSC=C3)N4CCOCC4

InChI

InChI=1S/C25H31N3O5S/c29-22(26-18-25(9-4-1-5-10-25)28-11-13-32-14-12-28)16-33-24(31)20-6-2-3-7-21(20)27-23(30)19-8-15-34-17-19/h2-3,6-8,15,17H,1,4-5,9-14,16,18H2,(H,26,29)(H,27,30)