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

Systemtic Name: N-[4,5-dimethyl-3-(4-methylphenyl)sulfonyl-1-propyl-pyrrol-2-yl]-2,2-dimethyl-propanamide Openeye Name: N-[4,5-dimethyl-1-propyl-3-(p-tolylsulfonyl)pyrrol-2-yl]-2,2-dimethyl-propanamide CAS Name: N-[4,5-dimethyl-3-(4-methylphenyl)sulfonyl-1-propyl-2-pyrrolyl]-2,2-dimethylpropanamide IUPAC Name: N-[4,5-dimethyl-3-(4-methylphenyl)sulfonyl-1-propylpyrrol-2-yl]-2,2-dimethylpropanamide Traditional Name: N-(4,5-dimethyl-1-propyl-3-tosyl-pyrrol-2-yl)-2,2-dimethyl-propionamide Formula: C21H30N2O3S MolecularWeight: 390.5395

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=C1NC(=O)C(C)(C)C)S(=O)(=O)C2=CC=C(C=C2)C)C)C

Isomeric SMILES

CCCN1C(=C(C(=C1NC(=O)C(C)(C)C)S(=O)(=O)C2=CC=C(C=C2)C)C)C

InChI

InChI=1S/C21H30N2O3S/c1-8-13-23-16(4)15(3)18(19(23)22-20(24)21(5,6)7)27(25,26)17-11-9-14(2)10-12-17/h9-12H,8,13H2,1-7H3,(H,22,24)