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

Systemtic Name: N-[4-(cyanomethyl)phenyl]-4-(2,5-dimethylpyrrol-1-yl)-N-propan-2-ylsulfonyl-benzamide Openeye Name: N-[4-(cyanomethyl)phenyl]-4-(2,5-dimethylpyrrol-1-yl)-N-isopropylsulfonyl-benzamide CAS Name: N-[4-(cyanomethyl)phenyl]-4-(2,5-dimethyl-1-pyrrolyl)-N-propan-2-ylsulfonylbenzamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-4-(2,5-dimethylpyrrol-1-yl)-N-propan-2-ylsulfonylbenzamide Traditional Name: N-[4-(cyanomethyl)phenyl]-4-(2,5-dimethylpyrrol-1-yl)-N-isopropylsulfonyl-benzamide Formula: C24H25N3O3S MolecularWeight: 435.5386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)N(C3=CC=C(C=C3)CC#N)S(=O)(=O)C(C)C)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)N(C3=CC=C(C=C3)CC#N)S(=O)(=O)C(C)C)C

InChI

InChI=1S/C24H25N3O3S/c1-17(2)31(29,30)27(23-11-7-20(8-12-23)15-16-25)24(28)21-9-13-22(14-10-21)26-18(3)5-6-19(26)4/h5-14,17H,15H2,1-4H3