N-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]-4-(thiophen-2-ylsulfonylamino)benzamide

Systemtic Name: N-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]-4-(thiophen-2-ylsulfonylamino)benzamide Openeye Name: N-[(E)-[3-(1,3-benzodioxol-5-yl)-1-methyl-propylidene]amino]-4-(2-thienylsulfonylamino)benzamide CAS Name: N-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]-4-(thiophen-2-ylsulfonylamino)benzamide IUPAC Name: N-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]-4-(thiophen-2-ylsulfonylamino)benzamide Traditional Name: N-[(E)-[3-(1,3-benzodioxol-5-yl)-1-methyl-propylidene]amino]-4-(2-thienylsulfonylamino)benzamide Formula: C22H21N3O5S2 MolecularWeight: 471.54924

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CS2)CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C/C(=N\NC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CS2)/CCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H21N3O5S2/c1-15(4-5-16-6-11-19-20(13-16)30-14-29-19)23-24-22(26)17-7-9-18(10-8-17)25-32(27,28)21-3-2-12-31-21/h2-3,6-13,25H,4-5,14H2,1H3,(H,24,26)/b23-15+