N-[(2S)-3-cyclohexyl-1-oxidanylidene-1-[[(4S)-3-oxidanylidene-1-pyridin-2-ylsulfonyl-azepan-4-yl]amino]propan-2-yl]-2,5-dimethyl-furan-3-carboxamide

Systemtic Name: N-[(2S)-3-cyclohexyl-1-oxidanylidene-1-[[(4S)-3-oxidanylidene-1-pyridin-2-ylsulfonyl-azepan-4-yl]amino]propan-2-yl]-2,5-dimethyl-furan-3-carboxamide Openeye Name: N-[(1S)-1-(cyclohexylmethyl)-2-oxo-2-[[(4S)-3-oxo-1-(2-pyridylsulfonyl)azepan-4-yl]amino]ethyl]-2,5-dimethyl-furan-3-carboxamide CAS Name: N-[(2S)-3-cyclohexyl-1-oxo-1-[[(4S)-3-oxo-1-(2-pyridinylsulfonyl)-4-azepanyl]amino]propan-2-yl]-2,5-dimethyl-3-furancarboxamide IUPAC Name: N-[(2S)-3-cyclohexyl-1-oxo-1-[[(4S)-3-oxo-1-pyridin-2-ylsulfonylazepan-4-yl]amino]propan-2-yl]-2,5-dimethylfuran-3-carboxamide Traditional Name: N-[(1S)-1-(cyclohexylmethyl)-2-keto-2-[[(4S)-3-keto-1-(2-pyridylsulfonyl)azepan-4-yl]amino]ethyl]-2,5-dimethyl-3-furamide Formula: C27H36N4O6S MolecularWeight: 544.66294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C(=O)NC(CC2CCCCC2)C(=O)NC3CCCN(CC3=O)S(=O)(=O)C4=CC=CC=N4

Isomeric SMILES

CC1=CC(=C(O1)C)C(=O)N[C@@H](CC2CCCCC2)C(=O)N[C@H]3CCCN(CC3=O)S(=O)(=O)C4=CC=CC=N4

InChI

InChI=1S/C27H36N4O6S/c1-18-15-21(19(2)37-18)26(33)30-23(16-20-9-4-3-5-10-20)27(34)29-22-11-8-14-31(17-24(22)32)38(35,36)25-12-6-7-13-28-25/h6-7,12-13,15,20,22-23H,3-5,8-11,14,16-17H2,1-2H3,(H,29,34)(H,30,33)/t22-,23-/m0/s1