4-tert-butyl-N-[2-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)ethyl]benzamide

Systemtic Name: 4-tert-butyl-N-[2-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)ethyl]benzamide Openeye Name: 4-tert-butyl-N-[2-[6-oxo-3-(2-thienyl)pyridazin-1-yl]ethyl]benzamide CAS Name: 4-tert-butyl-N-[2-(6-oxo-3-thiophen-2-yl-1-pyridazinyl)ethyl]benzamide IUPAC Name: 4-tert-butyl-N-[2-(6-oxo-3-thiophen-2-ylpyridazin-1-yl)ethyl]benzamide Traditional Name: 4-tert-butyl-N-[2-[6-keto-3-(2-thienyl)pyridazin-1-yl]ethyl]benzamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NCCN2C(=O)C=CC(=N2)C3=CC=CS3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NCCN2C(=O)C=CC(=N2)C3=CC=CS3

InChI

InChI=1S/C21H23N3O2S/c1-21(2,3)16-8-6-15(7-9-16)20(26)22-12-13-24-19(25)11-10-17(23-24)18-5-4-14-27-18/h4-11,14H,12-13H2,1-3H3,(H,22,26)