2-[(1-naphthalen-2-ylsulfonylazepan-4-yl)amino]-N-oxidanyl-pyrimidine-5-carboxamide

Systemtic Name: 2-[(1-naphthalen-2-ylsulfonylazepan-4-yl)amino]-N-oxidanyl-pyrimidine-5-carboxamide Openeye Name: 2-[[1-(2-naphthylsulfonyl)azepan-4-yl]amino]pyrimidine-5-carbohydroxamic acid CAS Name: N-hydroxy-2-[[1-(2-naphthalenylsulfonyl)-4-azepanyl]amino]-5-pyrimidinecarboxamide IUPAC Name: N-hydroxy-2-[(1-naphthalen-2-ylsulfonylazepan-4-yl)amino]pyrimidine-5-carboxamide Traditional Name: 2-[[1-(2-naphthylsulfonyl)azepan-4-yl]amino]pyrimidine-5-carbohydroxamic acid Formula: C21H23N5O4S MolecularWeight: 441.50342

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCN(C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)NC4=NC=C(C=N4)C(=O)NO

Isomeric SMILES

C1CC(CCN(C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)NC4=NC=C(C=N4)C(=O)NO

InChI

InChI=1S/C21H23N5O4S/c27-20(25-28)17-13-22-21(23-14-17)24-18-6-3-10-26(11-9-18)31(29,30)19-8-7-15-4-1-2-5-16(15)12-19/h1-2,4-5,7-8,12-14,18,28H,3,6,9-11H2,(H,25,27)(H,22,23,24)