2-methyl-N-(2-methylbut-3-yn-2-yl)-5-[[2-(pyridin-2-ylamino)-1,3-thiazol-5-yl]sulfanyl]benzamide

Systemtic Name: 2-methyl-N-(2-methylbut-3-yn-2-yl)-5-[[2-(pyridin-2-ylamino)-1,3-thiazol-5-yl]sulfanyl]benzamide Openeye Name: N-(1,1-dimethylprop-2-ynyl)-2-methyl-5-[2-(2-pyridylamino)thiazol-5-yl]sulfanyl-benzamide CAS Name: 2-methyl-N-(2-methylbut-3-yn-2-yl)-5-[[2-(2-pyridinylamino)-5-thiazolyl]thio]benzamide IUPAC Name: 2-methyl-N-(2-methylbut-3-yn-2-yl)-5-[[2-(pyridin-2-ylamino)-1,3-thiazol-5-yl]sulfanyl]benzamide Traditional Name: N-(1,1-dimethylprop-2-ynyl)-2-methyl-5-[[2-(2-pyridylamino)thiazol-5-yl]thio]benzamide Formula: C21H20N4OS2 MolecularWeight: 408.5397

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC2=CN=C(S2)NC3=CC=CC=N3)C(=O)NC(C)(C)C#C

Isomeric SMILES

CC1=C(C=C(C=C1)SC2=CN=C(S2)NC3=CC=CC=N3)C(=O)NC(C)(C)C#C

InChI

InChI=1S/C21H20N4OS2/c1-5-21(3,4)25-19(26)16-12-15(10-9-14(16)2)27-18-13-23-20(28-18)24-17-8-6-7-11-22-17/h1,6-13H,2-4H3,(H,25,26)(H,22,23,24)