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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[2-(3,4-dimethylphenyl)sulfanylethanoylamino]benzamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[[2-(3,4-dimethylphenyl)sulfanylacetyl]amino]benzamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[[2-[(3,4-dimethylphenyl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[[2-(3,4-dimethylphenyl)sulfanylacetyl]amino]benzamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[[2-[(3,4-dimethylphenyl)thio]acetyl]amino]benzamide Formula: C24H22N2O4S MolecularWeight: 434.50748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCC(=O)NC2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCC(=O)NC2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C24H22N2O4S/c1-15-7-9-18(11-16(15)2)31-13-23(27)26-20-6-4-3-5-19(20)24(28)25-17-8-10-21-22(12-17)30-14-29-21/h3-12H,13-14H2,1-2H3,(H,25,28)(H,26,27)