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

Systemtic Name: 2-[2-(4-acetamidophenyl)sulfanylethanoylamino]-N-(1,3-benzodioxol-5-yl)benzamide Openeye Name: 2-[[2-(4-acetamidophenyl)sulfanylacetyl]amino]-N-(1,3-benzodioxol-5-yl)benzamide CAS Name: 2-[[2-[(4-acetamidophenyl)thio]-1-oxoethyl]amino]-N-(1,3-benzodioxol-5-yl)benzamide IUPAC Name: 2-[[2-(4-acetamidophenyl)sulfanylacetyl]amino]-N-(1,3-benzodioxol-5-yl)benzamide Traditional Name: 2-[[2-[(4-acetamidophenyl)thio]acetyl]amino]-N-(1,3-benzodioxol-5-yl)benzamide Formula: C24H21N3O5S MolecularWeight: 463.50564

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SCC(=O)NC2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SCC(=O)NC2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H21N3O5S/c1-15(28)25-16-6-9-18(10-7-16)33-13-23(29)27-20-5-3-2-4-19(20)24(30)26-17-8-11-21-22(12-17)32-14-31-21/h2-12H,13-14H2,1H3,(H,25,28)(H,26,30)(H,27,29)