N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[4-(2,5-dimethyl-1-pyrrolyl)phenyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-3-pyrrolidinosulfonyl-benzamide Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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