3-pyrrolidin-1-ylsulfonyl-N-[(E)-1-(3,4,5-trimethoxyphenyl)ethylideneamino]benzamide

Systemtic Name: 3-pyrrolidin-1-ylsulfonyl-N-[(E)-1-(3,4,5-trimethoxyphenyl)ethylideneamino]benzamide Openeye Name: 3-pyrrolidin-1-ylsulfonyl-N-[(E)-1-(3,4,5-trimethoxyphenyl)ethylideneamino]benzamide CAS Name: 3-(1-pyrrolidinylsulfonyl)-N-[(E)-1-(3,4,5-trimethoxyphenyl)ethylideneamino]benzamide IUPAC Name: 3-pyrrolidin-1-ylsulfonyl-N-[(E)-1-(3,4,5-trimethoxyphenyl)ethylideneamino]benzamide Traditional Name: 3-pyrrolidinosulfonyl-N-[(E)-1-(3,4,5-trimethoxyphenyl)ethylideneamino]benzamide Formula: C22H27N3O6S MolecularWeight: 461.53128

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCC2)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

C/C(=N\NC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCC2)/C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C22H27N3O6S/c1-15(17-13-19(29-2)21(31-4)20(14-17)30-3)23-24-22(26)16-8-7-9-18(12-16)32(27,28)25-10-5-6-11-25/h7-9,12-14H,5-6,10-11H2,1-4H3,(H,24,26)/b23-15+