N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2,5-dimethyl-benzamide

Systemtic Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2,5-dimethyl-benzamide Openeye Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2,5-dimethyl-benzamide CAS Name: N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-2,5-dimethylbenzamide IUPAC Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)-2,5-dimethylbenzamide Traditional Name: N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)-2,5-dimethyl-benzamide Formula: C21H26N2O4S MolecularWeight: 402.50714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O4S/c1-4-27-19-10-9-17(14-20(19)28(25,26)23-11-5-6-12-23)22-21(24)18-13-15(2)7-8-16(18)3/h7-10,13-14H,4-6,11-12H2,1-3H3,(H,22,24)