(2R,5S)-5-(cyclohexylcarbonylamino)-6-oxidanylidene-1-pyridin-2-ylsulfonyl-azepane-2-carboxamide

Systemtic Name: (2R,5S)-5-(cyclohexylcarbonylamino)-6-oxidanylidene-1-pyridin-2-ylsulfonyl-azepane-2-carboxamide Openeye Name: (2R,5S)-5-(cyclohexanecarbonylamino)-6-oxo-1-(2-pyridylsulfonyl)azepane-2-carboxamide CAS Name: (2R,5S)-5-[[cyclohexyl(oxo)methyl]amino]-6-oxo-1-(2-pyridinylsulfonyl)-2-azepanecarboxamide IUPAC Name: (2R,5S)-5-(cyclohexanecarbonylamino)-6-oxo-1-pyridin-2-ylsulfonylazepane-2-carboxamide Traditional Name: (2R,5S)-5-(cyclohexanecarbonylamino)-6-keto-1-(2-pyridylsulfonyl)azepane-2-carboxamide Formula: C19H26N4O5S MolecularWeight: 422.49854

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2CCC(N(CC2=O)S(=O)(=O)C3=CC=CC=N3)C(=O)N

Isomeric SMILES

C1CCC(CC1)C(=O)N[C@H]2CC[C@@H](N(CC2=O)S(=O)(=O)C3=CC=CC=N3)C(=O)N

InChI

InChI=1S/C19H26N4O5S/c20-18(25)15-10-9-14(22-19(26)13-6-2-1-3-7-13)16(24)12-23(15)29(27,28)17-8-4-5-11-21-17/h4-5,8,11,13-15H,1-3,6-7,9-10,12H2,(H2,20,25)(H,22,26)/t14-,15+/m0/s1