N-(3-ethylpent-1-yn-3-yl)-3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-(3-ethylpent-1-yn-3-yl)-3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-1-benzofuran-2-carboxamide Openeye Name: N-(1,1-diethylprop-2-ynyl)-3-[(4-methylthiazol-2-yl)sulfanylmethyl]benzofuran-2-carboxamide CAS Name: N-(3-ethylpent-1-yn-3-yl)-3-[[(4-methyl-2-thiazolyl)thio]methyl]-2-benzofurancarboxamide IUPAC Name: N-(3-ethylpent-1-yn-3-yl)-3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-1-benzofuran-2-carboxamide Traditional Name: N-(1,1-diethylprop-2-ynyl)-3-[[(4-methylthiazol-2-yl)thio]methyl]coumarilamide Formula: C21H22N2O2S2 MolecularWeight: 398.54158

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)C1=C(C2=CC=CC=C2O1)CSC3=NC(=CS3)C

Isomeric SMILES

CCC(CC)(C#C)NC(=O)C1=C(C2=CC=CC=C2O1)CSC3=NC(=CS3)C

InChI

InChI=1S/C21H22N2O2S2/c1-5-21(6-2,7-3)23-19(24)18-16(13-27-20-22-14(4)12-26-20)15-10-8-9-11-17(15)25-18/h1,8-12H,6-7,13H2,2-4H3,(H,23,24)