N-(1,3-benzodioxol-5-yl)-2-[2-(4-methylquinolin-2-yl)sulfanylethanoylamino]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[2-(4-methylquinolin-2-yl)sulfanylethanoylamino]benzamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[[2-[(4-methyl-2-quinolyl)sulfanyl]acetyl]amino]benzamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[[2-[(4-methyl-2-quinolinyl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[[2-(4-methylquinolin-2-yl)sulfanylacetyl]amino]benzamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[[2-[(4-methyl-2-quinolyl)thio]acetyl]amino]benzamide Formula: C26H21N3O4S MolecularWeight: 471.52764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)NC3=CC=CC=C3C(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)NC3=CC=CC=C3C(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H21N3O4S/c1-16-12-25(29-20-8-4-2-6-18(16)20)34-14-24(30)28-21-9-5-3-7-19(21)26(31)27-17-10-11-22-23(13-17)33-15-32-22/h2-13H,14-15H2,1H3,(H,27,31)(H,28,30)