tert-butyl N-[4-methyl-1-[(5-methyl-3-oxidanyl-1-pyridin-2-ylsulfonyl-azepan-4-yl)amino]-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: tert-butyl N-[4-methyl-1-[(5-methyl-3-oxidanyl-1-pyridin-2-ylsulfonyl-azepan-4-yl)amino]-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: tert-butyl N-[1-[[3-hydroxy-5-methyl-1-(2-pyridylsulfonyl)azepan-4-yl]carbamoyl]-3-methyl-butyl]carbamate CAS Name: N-[1-[[3-hydroxy-5-methyl-1-(2-pyridinylsulfonyl)-4-azepanyl]amino]-4-methyl-1-oxopentan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[(3-hydroxy-5-methyl-1-pyridin-2-ylsulfonylazepan-4-yl)amino]-4-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[1-[[3-hydroxy-5-methyl-1-(2-pyridylsulfonyl)azepan-4-yl]carbamoyl]-3-methyl-butyl]carbamic acid tert-butyl ester Formula: C23H38N4O6S MolecularWeight: 498.63602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC(C1NC(=O)C(CC(C)C)NC(=O)OC(C)(C)C)O)S(=O)(=O)C2=CC=CC=N2

Isomeric SMILES

CC1CCN(CC(C1NC(=O)C(CC(C)C)NC(=O)OC(C)(C)C)O)S(=O)(=O)C2=CC=CC=N2

InChI

InChI=1S/C23H38N4O6S/c1-15(2)13-17(25-22(30)33-23(4,5)6)21(29)26-20-16(3)10-12-27(14-18(20)28)34(31,32)19-9-7-8-11-24-19/h7-9,11,15-18,20,28H,10,12-14H2,1-6H3,(H,25,30)(H,26,29)