4-[(1-methylpiperidin-3-yl)methylsulfanyl]-2-[2-methylpropyl-(4-phenylphenyl)sulfonyl-amino]-N-oxidanyl-butanamide

Systemtic Name: 4-[(1-methylpiperidin-3-yl)methylsulfanyl]-2-[2-methylpropyl-(4-phenylphenyl)sulfonyl-amino]-N-oxidanyl-butanamide Openeye Name: 2-[isobutyl-(4-phenylphenyl)sulfonyl-amino]-4-[(1-methyl-3-piperidyl)methylsulfanyl]butanehydroxamic acid CAS Name: N-hydroxy-4-[(1-methyl-3-piperidinyl)methylthio]-2-[2-methylpropyl-(4-phenylphenyl)sulfonylamino]butanamide IUPAC Name: N-hydroxy-4-[(1-methylpiperidin-3-yl)methylsulfanyl]-2-[2-methylpropyl-(4-phenylphenyl)sulfonylamino]butanamide Traditional Name: 2-[isobutyl-(4-phenylphenyl)sulfonyl-amino]-4-[(1-methyl-3-piperidyl)methylthio]butanehydroxamic acid Formula: C27H39N3O4S2 MolecularWeight: 533.74626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C(CCSCC1CCCN(C1)C)C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)CN(C(CCSCC1CCCN(C1)C)C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H39N3O4S2/c1-21(2)18-30(26(27(31)28-32)15-17-35-20-22-8-7-16-29(3)19-22)36(33,34)25-13-11-24(12-14-25)23-9-5-4-6-10-23/h4-6,9-14,21-22,26,32H,7-8,15-20H2,1-3H3,(H,28,31)