4-[(2-methylquinolin-4-yl)methoxy]-N-[3-[2-(oxidanylamino)-2-oxidanylidene-ethyl]-1-oxidanylidene-thian-3-yl]benzamide

Systemtic Name: 4-[(2-methylquinolin-4-yl)methoxy]-N-[3-[2-(oxidanylamino)-2-oxidanylidene-ethyl]-1-oxidanylidene-thian-3-yl]benzamide Openeye Name: N-[3-[2-(hydroxyamino)-2-oxo-ethyl]-1-oxo-thian-3-yl]-4-[(2-methyl-4-quinolyl)methoxy]benzamide CAS Name: N-[3-[2-(hydroxyamino)-2-oxoethyl]-1-oxo-3-thianyl]-4-[(2-methyl-4-quinolinyl)methoxy]benzamide IUPAC Name: N-[3-[2-(hydroxyamino)-2-oxoethyl]-1-oxothian-3-yl]-4-[(2-methylquinolin-4-yl)methoxy]benzamide Traditional Name: N-[3-[2-(hydroxyamino)-2-keto-ethyl]-1-keto-thian-3-yl]-4-[(2-methyl-4-quinolyl)methoxy]benzamide Formula: C25H27N3O5S MolecularWeight: 481.56398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)COC3=CC=C(C=C3)C(=O)NC4(CCCS(=O)C4)CC(=O)NO

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)COC3=CC=C(C=C3)C(=O)NC4(CCCS(=O)C4)CC(=O)NO

InChI

InChI=1S/C25H27N3O5S/c1-17-13-19(21-5-2-3-6-22(21)26-17)15-33-20-9-7-18(8-10-20)24(30)27-25(14-23(29)28-31)11-4-12-34(32)16-25/h2-3,5-10,13,31H,4,11-12,14-16H2,1H3,(H,27,30)(H,28,29)