N-[(2S)-3-cyclohexyl-1-[[(4S,7R)-7-methyl-3-oxidanylidene-1-pyridin-2-ylsulfonyl-azepan-4-yl]amino]-1-oxidanylidene-propan-2-yl]-2,5-dihydrofuran-2-carboxamide

Systemtic Name: N-[(2S)-3-cyclohexyl-1-[[(4S,7R)-7-methyl-3-oxidanylidene-1-pyridin-2-ylsulfonyl-azepan-4-yl]amino]-1-oxidanylidene-propan-2-yl]-2,5-dihydrofuran-2-carboxamide Openeye Name: N-[(1S)-1-(cyclohexylmethyl)-2-[[(4S,7R)-7-methyl-3-oxo-1-(2-pyridylsulfonyl)azepan-4-yl]amino]-2-oxo-ethyl]-2,5-dihydrofuran-2-carboxamide CAS Name: N-[(2S)-3-cyclohexyl-1-[[(4S,7R)-7-methyl-3-oxo-1-(2-pyridinylsulfonyl)-4-azepanyl]amino]-1-oxopropan-2-yl]-2,5-dihydrofuran-2-carboxamide IUPAC Name: N-[(2S)-3-cyclohexyl-1-[[(4S,7R)-7-methyl-3-oxo-1-pyridin-2-ylsulfonylazepan-4-yl]amino]-1-oxopropan-2-yl]-2,5-dihydrofuran-2-carboxamide Traditional Name: N-[(1S)-1-(cyclohexylmethyl)-2-keto-2-[[(4S,7R)-3-keto-7-methyl-1-(2-pyridylsulfonyl)azepan-4-yl]amino]ethyl]-2,5-dihydrofuran-2-carboxamide Formula: C26H36N4O6S MolecularWeight: 532.65224

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(=O)CN1S(=O)(=O)C2=CC=CC=N2)NC(=O)C(CC3CCCCC3)NC(=O)C4C=CCO4

Isomeric SMILES

C[C@@H]1CC[C@@H](C(=O)CN1S(=O)(=O)C2=CC=CC=N2)NC(=O)[C@H](CC3CCCCC3)NC(=O)C4C=CCO4

InChI

InChI=1S/C26H36N4O6S/c1-18-12-13-20(22(31)17-30(18)37(34,35)24-11-5-6-14-27-24)28-25(32)21(16-19-8-3-2-4-9-19)29-26(33)23-10-7-15-36-23/h5-7,10-11,14,18-21,23H,2-4,8-9,12-13,15-17H2,1H3,(H,28,32)(H,29,33)/t18-,20+,21+,23?/m1/s1