5-(4-ethynylphenyl)sulfinyl-6-methyl-N-[(4-methylsulfonylphenyl)methyl]-2-oxidanylidene-1-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide

Systemtic Name: 5-(4-ethynylphenyl)sulfinyl-6-methyl-N-[(4-methylsulfonylphenyl)methyl]-2-oxidanylidene-1-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide Openeye Name: 5-(4-ethynylphenyl)sulfinyl-6-methyl-N-[(4-methylsulfonylphenyl)methyl]-2-oxo-1-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide CAS Name: 5-(4-ethynylphenyl)sulfinyl-6-methyl-N-[(4-methylsulfonylphenyl)methyl]-2-oxo-1-[3-(trifluoromethyl)phenyl]-3-pyridinecarboxamide IUPAC Name: 5-(4-ethynylphenyl)sulfinyl-6-methyl-N-[(4-methylsulfonylphenyl)methyl]-2-oxo-1-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide Traditional Name: 5-(4-ethynylphenyl)sulfinyl-2-keto-N-(4-mesylbenzyl)-6-methyl-1-[3-(trifluoromethyl)phenyl]nicotinamide Formula: C30H23F3N2O5S2 MolecularWeight: 612.63923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)C(=O)NCC3=CC=C(C=C3)S(=O)(=O)C)S(=O)C4=CC=C(C=C4)C#C

Isomeric SMILES

CC1=C(C=C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)C(=O)NCC3=CC=C(C=C3)S(=O)(=O)C)S(=O)C4=CC=C(C=C4)C#C

InChI

InChI=1S/C30H23F3N2O5S2/c1-4-20-8-12-24(13-9-20)41(38)27-17-26(28(36)34-18-21-10-14-25(15-11-21)42(3,39)40)29(37)35(19(27)2)23-7-5-6-22(16-23)30(31,32)33/h1,5-17H,18H2,2-3H3,(H,34,36)