N-[1-cyclopentyl-4,5-dimethyl-3-(4-methylphenyl)sulfonyl-pyrrol-2-yl]propanamide

Systemtic Name: N-[1-cyclopentyl-4,5-dimethyl-3-(4-methylphenyl)sulfonyl-pyrrol-2-yl]propanamide Openeye Name: N-[1-cyclopentyl-4,5-dimethyl-3-(p-tolylsulfonyl)pyrrol-2-yl]propanamide CAS Name: N-[1-cyclopentyl-4,5-dimethyl-3-(4-methylphenyl)sulfonyl-2-pyrrolyl]propanamide IUPAC Name: N-[1-cyclopentyl-4,5-dimethyl-3-(4-methylphenyl)sulfonylpyrrol-2-yl]propanamide Traditional Name: N-(1-cyclopentyl-4,5-dimethyl-3-tosyl-pyrrol-2-yl)propionamide Formula: C21H28N2O3S MolecularWeight: 388.52362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C(=C(N1C2CCCC2)C)C)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC(=O)NC1=C(C(=C(N1C2CCCC2)C)C)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H28N2O3S/c1-5-19(24)22-21-20(27(25,26)18-12-10-14(2)11-13-18)15(3)16(4)23(21)17-8-6-7-9-17/h10-13,17H,5-9H2,1-4H3,(H,22,24)