(2S,4R)-2-methyl-4-[3-[4-(2-methylpyrazol-3-yl)phenyl]sulfanylphenyl]oxane-4-carboxamide

Systemtic Name: (2S,4R)-2-methyl-4-[3-[4-(2-methylpyrazol-3-yl)phenyl]sulfanylphenyl]oxane-4-carboxamide Openeye Name: (2S,4R)-2-methyl-4-[3-[4-(2-methylpyrazol-3-yl)phenyl]sulfanylphenyl]tetrahydropyran-4-carboxamide CAS Name: (2S,4R)-2-methyl-4-[3-[[4-(2-methyl-3-pyrazolyl)phenyl]thio]phenyl]-4-oxanecarboxamide IUPAC Name: (2S,4R)-2-methyl-4-[3-[4-(2-methylpyrazol-3-yl)phenyl]sulfanylphenyl]oxane-4-carboxamide Traditional Name: (2S,4R)-2-methyl-4-[3-[[4-(2-methylpyrazol-3-yl)phenyl]thio]phenyl]tetrahydropyran-4-carboxamide Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CCO1)(C2=CC(=CC=C2)SC3=CC=C(C=C3)C4=CC=NN4C)C(=O)N

Isomeric SMILES

C[C@H]1C[C@](CCO1)(C2=CC(=CC=C2)SC3=CC=C(C=C3)C4=CC=NN4C)C(=O)N

InChI

InChI=1S/C23H25N3O2S/c1-16-15-23(22(24)27,11-13-28-16)18-4-3-5-20(14-18)29-19-8-6-17(7-9-19)21-10-12-25-26(21)2/h3-10,12,14,16H,11,13,15H2,1-2H3,(H2,24,27)/t16-,23+/m0/s1