(2S)-3-[(1-methylimidazol-2-yl)methylsulfanyl]-2-[methyl-(4-pyridin-4-yloxyphenyl)sulfonyl-amino]-N-oxidanyl-propanamide

Systemtic Name: (2S)-3-[(1-methylimidazol-2-yl)methylsulfanyl]-2-[methyl-(4-pyridin-4-yloxyphenyl)sulfonyl-amino]-N-oxidanyl-propanamide Openeye Name: (2S)-3-[(1-methylimidazol-2-yl)methylsulfanyl]-2-[methyl-[4-(4-pyridyloxy)phenyl]sulfonyl-amino]propanehydroxamic acid CAS Name: (2S)-N-hydroxy-3-[(1-methyl-2-imidazolyl)methylthio]-2-[methyl-(4-pyridin-4-yloxyphenyl)sulfonylamino]propanamide IUPAC Name: (2S)-N-hydroxy-3-[(1-methylimidazol-2-yl)methylsulfanyl]-2-[methyl-(4-pyridin-4-yloxyphenyl)sulfonylamino]propanamide Traditional Name: (2S)-3-[(1-methylimidazol-2-yl)methylthio]-2-[methyl-[4-(4-pyridyloxy)phenyl]sulfonyl-amino]propanehydroxamic acid Formula: C20H23N5O5S2 MolecularWeight: 477.55712

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1CSCC(C(=O)NO)N(C)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=NC=C3

Isomeric SMILES

CN1C=CN=C1CSC[C@H](C(=O)NO)N(C)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=NC=C3

InChI

InChI=1S/C20H23N5O5S2/c1-24-12-11-22-19(24)14-31-13-18(20(26)23-27)25(2)32(28,29)17-5-3-15(4-6-17)30-16-7-9-21-10-8-16/h3-12,18,27H,13-14H2,1-2H3,(H,23,26)/t18-/m1/s1