N-(2-chloranyl-4,6-dimethyl-phenyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: N-(2-chloranyl-4,6-dimethyl-phenyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: N-(2-chloro-4,6-dimethyl-phenyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: N-(2-chloro-4,6-dimethylphenyl)-3-[4-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: N-(2-chloro-4,6-dimethylphenyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: N-(2-chloro-4,6-dimethyl-phenyl)-3-(4-pyrrolidinosulfonylphenyl)propionamide Formula: C21H25ClN2O3S MolecularWeight: 420.9528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C

InChI

InChI=1S/C21H25ClN2O3S/c1-15-13-16(2)21(19(22)14-15)23-20(25)10-7-17-5-8-18(9-6-17)28(26,27)24-11-3-4-12-24/h5-6,8-9,13-14H,3-4,7,10-12H2,1-2H3,(H,23,25)