4-[2-[5-methoxy-2-[(1-methylimidazol-2-yl)sulfanylmethyl]-4-oxidanylidene-pyridin-1-yl]ethanoylamino]benzamide

Systemtic Name: 4-[2-[5-methoxy-2-[(1-methylimidazol-2-yl)sulfanylmethyl]-4-oxidanylidene-pyridin-1-yl]ethanoylamino]benzamide Openeye Name: 4-[[2-[5-methoxy-2-[(1-methylimidazol-2-yl)sulfanylmethyl]-4-oxo-1-pyridyl]acetyl]amino]benzamide CAS Name: 4-[[2-[5-methoxy-2-[[(1-methyl-2-imidazolyl)thio]methyl]-4-oxo-1-pyridinyl]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[5-methoxy-2-[(1-methylimidazol-2-yl)sulfanylmethyl]-4-oxopyridin-1-yl]acetyl]amino]benzamide Traditional Name: 4-[[2-[4-keto-5-methoxy-2-[[(1-methylimidazol-2-yl)thio]methyl]-1-pyridyl]acetyl]amino]benzamide Formula: C20H21N5O4S MolecularWeight: 427.47684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC2=CC(=O)C(=CN2CC(=O)NC3=CC=C(C=C3)C(=O)N)OC

Isomeric SMILES

CN1C=CN=C1SCC2=CC(=O)C(=CN2CC(=O)NC3=CC=C(C=C3)C(=O)N)OC

InChI

InChI=1S/C20H21N5O4S/c1-24-8-7-22-20(24)30-12-15-9-16(26)17(29-2)10-25(15)11-18(27)23-14-5-3-13(4-6-14)19(21)28/h3-10H,11-12H2,1-2H3,(H2,21,28)(H,23,27)