N-[3-(cyclohexylmethylsulfonyl)-1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl]cycloheptanecarboxamide

Systemtic Name: N-[3-(cyclohexylmethylsulfonyl)-1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl]cycloheptanecarboxamide Openeye Name: N-[1-(cyclohexylmethylsulfonylmethyl)-2-[(4-methoxyphenyl)methylamino]-2-oxo-ethyl]cycloheptanecarboxamide CAS Name: N-[3-(cyclohexylmethylsulfonyl)-1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl]cycloheptanecarboxamide IUPAC Name: N-[3-(cyclohexylmethylsulfonyl)-1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl]cycloheptanecarboxamide Traditional Name: N-[1-(cyclohexylmethylsulfonylmethyl)-2-keto-2-(p-anisylamino)ethyl]cycloheptanecarboxamide Formula: C26H40N2O5S MolecularWeight: 492.6712

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C(CS(=O)(=O)CC2CCCCC2)NC(=O)C3CCCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)C(CS(=O)(=O)CC2CCCCC2)NC(=O)C3CCCCCC3

InChI

InChI=1S/C26H40N2O5S/c1-33-23-15-13-20(14-16-23)17-27-26(30)24(28-25(29)22-11-7-2-3-8-12-22)19-34(31,32)18-21-9-5-4-6-10-21/h13-16,21-22,24H,2-12,17-19H2,1H3,(H,27,30)(H,28,29)