N-[(2S)-4,4-dimethyl-1-oxidanylidene-1-[[(4S)-3-oxidanylidene-1-pyridin-2-ylsulfonyl-azepan-4-yl]amino]pentan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[(2S)-4,4-dimethyl-1-oxidanylidene-1-[[(4S)-3-oxidanylidene-1-pyridin-2-ylsulfonyl-azepan-4-yl]amino]pentan-2-yl]thiophene-2-carboxamide Openeye Name: N-[(1S)-3,3-dimethyl-1-[[(4S)-3-oxo-1-(2-pyridylsulfonyl)azepan-4-yl]carbamoyl]butyl]thiophene-2-carboxamide CAS Name: N-[(2S)-4,4-dimethyl-1-oxo-1-[[(4S)-3-oxo-1-(2-pyridinylsulfonyl)-4-azepanyl]amino]pentan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[(2S)-4,4-dimethyl-1-oxo-1-[[(4S)-3-oxo-1-pyridin-2-ylsulfonylazepan-4-yl]amino]pentan-2-yl]thiophene-2-carboxamide Traditional Name: N-[(1S)-1-[[(4S)-3-keto-1-(2-pyridylsulfonyl)azepan-4-yl]carbamoyl]-3,3-dimethyl-butyl]thiophene-2-carboxamide Formula: C23H30N4O5S2 MolecularWeight: 506.6381

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C(=O)NC1CCCN(CC1=O)S(=O)(=O)C2=CC=CC=N2)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)(C)C[C@@H](C(=O)N[C@H]1CCCN(CC1=O)S(=O)(=O)C2=CC=CC=N2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C23H30N4O5S2/c1-23(2,3)14-17(26-22(30)19-9-7-13-33-19)21(29)25-16-8-6-12-27(15-18(16)28)34(31,32)20-10-4-5-11-24-20/h4-5,7,9-11,13,16-17H,6,8,12,14-15H2,1-3H3,(H,25,29)(H,26,30)/t16-,17-/m0/s1