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

Systemtic Name: N-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]-3-(diethylsulfamoyl)benzamide Openeye Name: N-[(E)-[3-(1,3-benzodioxol-5-yl)-1-methyl-propylidene]amino]-3-(diethylsulfamoyl)benzamide CAS Name: N-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]-3-(diethylsulfamoyl)benzamide IUPAC Name: N-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]-3-(diethylsulfamoyl)benzamide Traditional Name: N-[(E)-[3-(1,3-benzodioxol-5-yl)-1-methyl-propylidene]amino]-3-(diethylsulfamoyl)benzamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NN=C(C)CCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)N/N=C(\C)/CCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C22H27N3O5S/c1-4-25(5-2)31(27,28)19-8-6-7-18(14-19)22(26)24-23-16(3)9-10-17-11-12-20-21(13-17)30-15-29-20/h6-8,11-14H,4-5,9-10,15H2,1-3H3,(H,24,26)/b23-16+