N-[(4R)-4-[(4-methylsulfanylphenyl)sulfonylmethyl]oxan-3-yl]-2-(4-nitro-1H-benzimidazol-2-yl)ethanamide

Systemtic Name: N-[(4R)-4-[(4-methylsulfanylphenyl)sulfonylmethyl]oxan-3-yl]-2-(4-nitro-1H-benzimidazol-2-yl)ethanamide Openeye Name: N-[(4R)-4-[(4-methylsulfanylphenyl)sulfonylmethyl]tetrahydropyran-3-yl]-2-(4-nitro-1H-benzimidazol-2-yl)acetamide CAS Name: N-[(4R)-4-[[4-(methylthio)phenyl]sulfonylmethyl]-3-oxanyl]-2-(4-nitro-1H-benzimidazol-2-yl)acetamide IUPAC Name: N-[(4R)-4-[(4-methylsulfanylphenyl)sulfonylmethyl]oxan-3-yl]-2-(4-nitro-1H-benzimidazol-2-yl)acetamide Traditional Name: N-[(4R)-4-[[4-(methylthio)phenyl]sulfonylmethyl]tetrahydropyran-3-yl]-2-(4-nitro-1H-benzimidazol-2-yl)acetamide Formula: C22H24N4O6S2 MolecularWeight: 504.57916

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)S(=O)(=O)CC2CCOCC2NC(=O)CC3=NC4=C(N3)C=CC=C4[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)S(=O)(=O)C[C@@H]2CCOCC2NC(=O)CC3=NC4=C(N3)C=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O6S2/c1-33-15-5-7-16(8-6-15)34(30,31)13-14-9-10-32-12-18(14)24-21(27)11-20-23-17-3-2-4-19(26(28)29)22(17)25-20/h2-8,14,18H,9-13H2,1H3,(H,23,25)(H,24,27)/t14-,18?/m0/s1