N-[4-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-oxidanylidene-chromen-7-yl]ethanamide

Systemtic Name: N-[4-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-oxidanylidene-chromen-7-yl]ethanamide Openeye Name: N-[4-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-oxo-chromen-7-yl]acetamide CAS Name: N-[4-[[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]methyl]-2-oxo-1-benzopyran-7-yl]acetamide IUPAC Name: N-[4-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-oxochromen-7-yl]acetamide Traditional Name: N-[4-[[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]methyl]-2-keto-chromen-7-yl]acetamide Formula: C22H20N4O3S MolecularWeight: 420.4842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC(=O)OC3=C2C=CC(=C3)NC(=O)C)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC(=O)OC3=C2C=CC(=C3)NC(=O)C)C4=CC=CC=C4

InChI

InChI=1S/C22H20N4O3S/c1-3-26-21(15-7-5-4-6-8-15)24-25-22(26)30-13-16-11-20(28)29-19-12-17(23-14(2)27)9-10-18(16)19/h4-12H,3,13H2,1-2H3,(H,23,27)