(3S)-4-[4-(7-azanylhept-2-ynoxy)phenyl]sulfonyl-2,2-dimethyl-N-oxidanyl-thiomorpholine-3-carboxamide

Systemtic Name: (3S)-4-[4-(7-azanylhept-2-ynoxy)phenyl]sulfonyl-2,2-dimethyl-N-oxidanyl-thiomorpholine-3-carboxamide Openeye Name: (3S)-4-[4-(7-aminohept-2-ynoxy)phenyl]sulfonyl-2,2-dimethyl-thiomorpholine-3-carbohydroxamic acid CAS Name: (3S)-4-[4-(7-aminohept-2-ynoxy)phenyl]sulfonyl-N-hydroxy-2,2-dimethyl-3-thiomorpholinecarboxamide IUPAC Name: (3S)-4-[4-(7-aminohept-2-ynoxy)phenyl]sulfonyl-N-hydroxy-2,2-dimethylthiomorpholine-3-carboxamide Traditional Name: (3S)-4-[4-(7-aminohept-2-ynoxy)phenyl]sulfonyl-2,2-dimethyl-thiomorpholine-3-carbohydroxamic acid Formula: C20H29N3O5S2 MolecularWeight: 455.59136

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(CCS1)S(=O)(=O)C2=CC=C(C=C2)OCC#CCCCCN)C(=O)NO)C

Isomeric SMILES

CC1([C@@H](N(CCS1)S(=O)(=O)C2=CC=C(C=C2)OCC#CCCCCN)C(=O)NO)C

InChI

InChI=1S/C20H29N3O5S2/c1-20(2)18(19(24)22-25)23(13-15-29-20)30(26,27)17-10-8-16(9-11-17)28-14-7-5-3-4-6-12-21/h8-11,18,25H,3-4,6,12-15,21H2,1-2H3,(H,22,24)/t18-/m0/s1