N-(1,3-benzodioxol-5-yl)-4-[ethyl-(4-methylsulfanylphenyl)sulfonyl-amino]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-4-[ethyl-(4-methylsulfanylphenyl)sulfonyl-amino]benzamide Openeye Name: N-(1,3-benzodioxol-5-yl)-4-[ethyl-(4-methylsulfanylphenyl)sulfonyl-amino]benzamide CAS Name: N-(1,3-benzodioxol-5-yl)-4-[ethyl-[4-(methylthio)phenyl]sulfonylamino]benzamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-4-[ethyl-(4-methylsulfanylphenyl)sulfonylamino]benzamide Traditional Name: N-(1,3-benzodioxol-5-yl)-4-[ethyl-[4-(methylthio)phenyl]sulfonyl-amino]benzamide Formula: C23H22N2O5S2 MolecularWeight: 470.56118

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=C(C=C4)SC

Isomeric SMILES

CCN(C1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=C(C=C4)SC

InChI

InChI=1S/C23H22N2O5S2/c1-3-25(32(27,28)20-11-9-19(31-2)10-12-20)18-7-4-16(5-8-18)23(26)24-17-6-13-21-22(14-17)30-15-29-21/h4-14H,3,15H2,1-2H3,(H,24,26)