N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-4-(2,5-dimethylphenyl)-4-oxidanylidene-butanamide

Systemtic Name: N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-4-(2,5-dimethylphenyl)-4-oxidanylidene-butanamide Openeye Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)-4-(2,5-dimethylphenyl)-4-oxo-butanamide CAS Name: N-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-4-(2,5-dimethylphenyl)-4-oxobutanamide IUPAC Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-4-(2,5-dimethylphenyl)-4-oxobutanamide Traditional Name: N-(4-chloro-3-pyrrolidinosulfonyl-phenyl)-4-(2,5-dimethylphenyl)-4-keto-butyramide Formula: C22H25ClN2O4S MolecularWeight: 448.9629

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)CCC(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)CCC(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C22H25ClN2O4S/c1-15-5-6-16(2)18(13-15)20(26)9-10-22(27)24-17-7-8-19(23)21(14-17)30(28,29)25-11-3-4-12-25/h5-8,13-14H,3-4,9-12H2,1-2H3,(H,24,27)