7-(5-methylthiophen-2-yl)-4,7-bis(oxidanylidene)-N-[3-(2-pyridin-2-ylethynyl)phenyl]heptanamide

Systemtic Name: 7-(5-methylthiophen-2-yl)-4,7-bis(oxidanylidene)-N-[3-(2-pyridin-2-ylethynyl)phenyl]heptanamide Openeye Name: 7-(5-methyl-2-thienyl)-4,7-dioxo-N-[3-[2-(2-pyridyl)ethynyl]phenyl]heptanamide CAS Name: 7-(5-methyl-2-thiophenyl)-4,7-dioxo-N-[3-[2-(2-pyridinyl)ethynyl]phenyl]heptanamide IUPAC Name: 7-(5-methylthiophen-2-yl)-4,7-dioxo-N-[3-(2-pyridin-2-ylethynyl)phenyl]heptanamide Traditional Name: 4,7-diketo-7-(5-methyl-2-thienyl)-N-[3-[2-(2-pyridyl)ethynyl]phenyl]enanthamide Formula: C25H22N2O3S MolecularWeight: 430.51878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)NC2=CC=CC(=C2)C#CC3=CC=CC=N3

Isomeric SMILES

CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)NC2=CC=CC(=C2)C#CC3=CC=CC=N3

InChI

InChI=1S/C25H22N2O3S/c1-18-8-14-24(31-18)23(29)13-11-22(28)12-15-25(30)27-21-7-4-5-19(17-21)9-10-20-6-2-3-16-26-20/h2-8,14,16-17H,11-13,15H2,1H3,(H,27,30)