4-methyl-N-[3-(2-pyridin-2-ylethynyl)phenyl]-2-(2,5,6-trimethyl-3-oxidanylidene-pyridazin-4-yl)-1,3-thiazole-5-carboxamide

Systemtic Name: 4-methyl-N-[3-(2-pyridin-2-ylethynyl)phenyl]-2-(2,5,6-trimethyl-3-oxidanylidene-pyridazin-4-yl)-1,3-thiazole-5-carboxamide Openeye Name: 4-methyl-N-[3-[2-(2-pyridyl)ethynyl]phenyl]-2-(2,5,6-trimethyl-3-oxo-pyridazin-4-yl)thiazole-5-carboxamide CAS Name: 4-methyl-N-[3-[2-(2-pyridinyl)ethynyl]phenyl]-2-(2,5,6-trimethyl-3-oxo-4-pyridazinyl)-5-thiazolecarboxamide IUPAC Name: 4-methyl-N-[3-(2-pyridin-2-ylethynyl)phenyl]-2-(2,5,6-trimethyl-3-oxopyridazin-4-yl)-1,3-thiazole-5-carboxamide Traditional Name: 2-(3-keto-2,5,6-trimethyl-pyridazin-4-yl)-4-methyl-N-[3-[2-(2-pyridyl)ethynyl]phenyl]thiazole-5-carboxamide Formula: C25H21N5O2S MolecularWeight: 455.53154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)C)C2=NC(=C(S2)C(=O)NC3=CC=CC(=C3)C#CC4=CC=CC=N4)C

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)C)C2=NC(=C(S2)C(=O)NC3=CC=CC(=C3)C#CC4=CC=CC=N4)C

InChI

InChI=1S/C25H21N5O2S/c1-15-16(2)29-30(4)25(32)21(15)24-27-17(3)22(33-24)23(31)28-20-10-7-8-18(14-20)11-12-19-9-5-6-13-26-19/h5-10,13-14H,1-4H3,(H,28,31)