N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[4-(2,5-dimethyl-1-pyrrolyl)phenyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-4-pyrrolidinosulfonyl-benzamide Formula: C23H25N3O3S MolecularWeight: 423.5279

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4)C

InChI

InChI=1S/C23H25N3O3S/c1-17-5-6-18(2)26(17)21-11-9-20(10-12-21)24-23(27)19-7-13-22(14-8-19)30(28,29)25-15-3-4-16-25/h5-14H,3-4,15-16H2,1-2H3,(H,24,27)