N-(2-cyano-4,5-diethoxy-phenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(2-cyano-4,5-diethoxy-phenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(2-cyano-4,5-diethoxy-phenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(2-cyano-4,5-diethoxyphenyl)-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(2-cyano-4,5-diethoxyphenyl)-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(2-cyano-4,5-diethoxy-phenyl)-3-pyrrolidinosulfonyl-benzamide Formula: C22H25N3O5S MolecularWeight: 443.516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C#N)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C#N)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3)OCC

InChI

InChI=1S/C22H25N3O5S/c1-3-29-20-13-17(15-23)19(14-21(20)30-4-2)24-22(26)16-8-7-9-18(12-16)31(27,28)25-10-5-6-11-25/h7-9,12-14H,3-6,10-11H2,1-2H3,(H,24,26)