4-[4-[4-(2-methylimidazol-1-yl)phenyl]sulfanylphenyl]oxane-4-carboxamide

Systemtic Name: 4-[4-[4-(2-methylimidazol-1-yl)phenyl]sulfanylphenyl]oxane-4-carboxamide Openeye Name: 4-[4-[4-(2-methylimidazol-1-yl)phenyl]sulfanylphenyl]tetrahydropyran-4-carboxamide CAS Name: 4-[4-[[4-(2-methyl-1-imidazolyl)phenyl]thio]phenyl]-4-oxanecarboxamide IUPAC Name: 4-[4-[4-(2-methylimidazol-1-yl)phenyl]sulfanylphenyl]oxane-4-carboxamide Traditional Name: 4-[4-[[4-(2-methylimidazol-1-yl)phenyl]thio]phenyl]tetrahydropyran-4-carboxamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1C2=CC=C(C=C2)SC3=CC=C(C=C3)C4(CCOCC4)C(=O)N

Isomeric SMILES

CC1=NC=CN1C2=CC=C(C=C2)SC3=CC=C(C=C3)C4(CCOCC4)C(=O)N

InChI

InChI=1S/C22H23N3O2S/c1-16-24-12-13-25(16)18-4-8-20(9-5-18)28-19-6-2-17(3-7-19)22(21(23)26)10-14-27-15-11-22/h2-9,12-13H,10-11,14-15H2,1H3,(H2,23,26)