1-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-N-(3-morpholin-4-ylsulfonylphenyl)cyclohexane-1-carboxamide

Systemtic Name: 1-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-N-(3-morpholin-4-ylsulfonylphenyl)cyclohexane-1-carboxamide Openeye Name: 1-[2-(cyclopropylamino)-2-oxo-ethyl]-N-(3-morpholinosulfonylphenyl)cyclohexanecarboxamide CAS Name: 1-[2-(cyclopropylamino)-2-oxoethyl]-N-[3-(4-morpholinylsulfonyl)phenyl]-1-cyclohexanecarboxamide IUPAC Name: 1-[2-(cyclopropylamino)-2-oxoethyl]-N-(3-morpholin-4-ylsulfonylphenyl)cyclohexane-1-carboxamide Traditional Name: 1-[2-(cyclopropylamino)-2-keto-ethyl]-N-(3-morpholinosulfonylphenyl)cyclohexanecarboxamide Formula: C22H31N3O5S MolecularWeight: 449.56364

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CC(=O)NC2CC2)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CCC(CC1)(CC(=O)NC2CC2)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H31N3O5S/c26-20(23-17-7-8-17)16-22(9-2-1-3-10-22)21(27)24-18-5-4-6-19(15-18)31(28,29)25-11-13-30-14-12-25/h4-6,15,17H,1-3,7-14,16H2,(H,23,26)(H,24,27)