1-azanyl-N-[(3S,4S,7R)-7-methyl-3-oxidanyl-1-pyridin-2-ylsulfonyl-azepan-4-yl]cyclohexane-1-carboxamide

Systemtic Name: 1-azanyl-N-[(3S,4S,7R)-7-methyl-3-oxidanyl-1-pyridin-2-ylsulfonyl-azepan-4-yl]cyclohexane-1-carboxamide Openeye Name: 1-amino-N-[(3S,4S,7R)-3-hydroxy-7-methyl-1-(2-pyridylsulfonyl)azepan-4-yl]cyclohexanecarboxamide CAS Name: 1-amino-N-[(3S,4S,7R)-3-hydroxy-7-methyl-1-(2-pyridinylsulfonyl)-4-azepanyl]-1-cyclohexanecarboxamide IUPAC Name: 1-amino-N-[(3S,4S,7R)-3-hydroxy-7-methyl-1-pyridin-2-ylsulfonylazepan-4-yl]cyclohexane-1-carboxamide Traditional Name: 1-amino-N-[(3S,4S,7R)-3-hydroxy-7-methyl-1-(2-pyridylsulfonyl)azepan-4-yl]cyclohexanecarboxamide Formula: C19H30N4O4S MolecularWeight: 410.5309

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(CN1S(=O)(=O)C2=CC=CC=N2)O)NC(=O)C3(CCCCC3)N

Isomeric SMILES

C[C@@H]1CC[C@@H]([C@H](CN1S(=O)(=O)C2=CC=CC=N2)O)NC(=O)C3(CCCCC3)N

InChI

InChI=1S/C19H30N4O4S/c1-14-8-9-15(22-18(25)19(20)10-4-2-5-11-19)16(24)13-23(14)28(26,27)17-7-3-6-12-21-17/h3,6-7,12,14-16,24H,2,4-5,8-11,13,20H2,1H3,(H,22,25)/t14-,15+,16+/m1/s1