N-[4-[2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylethanoyl]phenyl]methanesulfonamide

Systemtic Name: N-[4-[2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylethanoyl]phenyl]methanesulfonamide Openeye Name: N-[4-[2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylacetyl]phenyl]methanesulfonamide CAS Name: N-[4-[2-[[1-(3,5-dimethylphenyl)-2-imidazolyl]thio]-1-oxoethyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylacetyl]phenyl]methanesulfonamide Traditional Name: N-[4-[2-[[1-(3,5-dimethylphenyl)imidazol-2-yl]thio]acetyl]phenyl]methanesulfonamide Formula: C20H21N3O3S2 MolecularWeight: 415.52904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C=CN=C2SCC(=O)C3=CC=C(C=C3)NS(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C=CN=C2SCC(=O)C3=CC=C(C=C3)NS(=O)(=O)C)C

InChI

InChI=1S/C20H21N3O3S2/c1-14-10-15(2)12-18(11-14)23-9-8-21-20(23)27-13-19(24)16-4-6-17(7-5-16)22-28(3,25)26/h4-12,22H,13H2,1-3H3